Datasets:
reactants stringlengths 66 183 | product_both stringclasses 32 values | product1 stringclasses 32 values | product2 stringclasses 32 values |
|---|---|---|---|
NS(=O)(=O)c1ccccc1I.OB(O)c1ccc(C(F)(F)F)cc1>O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].CCN(C(C)C)C(C)C.CC#N | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1ccccc1I>O=S(=O)(c1ccccc1I)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1ccccc1I | O=S(=O)(c1ccccc1I)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
CC(C)(C)OC(=O)N1CCC(S(N)(=O)=O)CC1.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CCN(CC)CC.CO | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
Cc1cc(CS(N)(=O)=O)no1.COc1ccc(B(O)O)cc1>O=P([O-])([O-])[O-].[K+].[K+].[K+].CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CCOC(C)=O | COc1ccc(NS(=O)(=O)Cc2cc(C)on2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cc(C)on2)cc1 | COc1ccc(NS(=O)(=O)Cc2cc(C)on2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cc(C)on2)cc1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CCN(CC)CC.CCOC(C)=O.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.OB(O)c1ccc(C(F)(F)F)cc1>CCOC(C)=O.CC(=O)[O-].CC(=O)[O-].[Cu+2].CN(C)c1ccncc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1>Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 |
CN(C)CCS(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].CCN(C(C)C)C(C)C | CN(C)CCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CN(C)CCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CN(C)CCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CN(C)CCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
COc1cccc2c(S(N)(=O)=O)cccc12.COc1ccc(B(O)O)cc1>CC#N.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].O=P([O-])([O-])[O-].[K+].[K+].[K+] | COc1ccc(NS(=O)(=O)c2cccc3c(OC)cccc23)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc3c(OC)cccc23)cc1 | COc1ccc(NS(=O)(=O)c2cccc3c(OC)cccc23)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc3c(OC)cccc23)cc1 |
NS(=O)(=O)c1ccc(-c2ccccn2)s1.COc1ccc(B(O)O)cc1>O=C([O-])[O-].[K+].[K+].CC(=O)[O-].CC(=O)[O-].[Cu+2].CCOC(C)=O | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 |
Cc1cc(CS(N)(=O)=O)no1.OB(O)c1ccc(C(F)(F)F)cc1>CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].ClCCCl.CCN(CC)CC | Cc1cc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cc2)no1>Cc1cc(CS(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)no1 | Cc1cc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cc2)no1 | Cc1cc(CS(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)no1 |
Cn1cc(S(N)(=O)=O)c2ccccc21.COc1ccc(B(O)O)cc1>CO.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CCN(C(C)C)C(C)C | COc1ccc(NS(=O)(=O)c2cn(C)c3ccccc23)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cn(C)c3ccccc23)cc1 | COc1ccc(NS(=O)(=O)c2cn(C)c3ccccc23)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cn(C)c3ccccc23)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.OB(O)c1ccc(C(F)(F)F)cc1>CO.CC(=O)[O-].CC(=O)[O-].[Cu+2] | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 |
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1.COc1ccc(B(O)O)cc1>CN(C)c1ccncc1.ClCCCl.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+] | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.COc1ccc(B(O)O)cc1>CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].O=C([O-])[O-].[K+].[K+].CC#N | COc1ccc(NS(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 |
NS(=O)(=O)Cc1cccc(C(F)(F)F)c1.COc1ccc(B(O)O)cc1>ClCCCl.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].O=C([O-])[O-].[K+].[K+] | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 |
CC(C)(C)OC(=O)N1CCC(S(N)(=O)=O)CC1.COc1ccc(B(O)O)cc1>CCN(C(C)C)C(C)C.CCOC(C)=O.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+] | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 |
NS(=O)(=O)Cc1cccc(C(F)(F)F)c1.COc1ccc(B(O)O)cc1>CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CCN(C(C)C)C(C)C.CCOC(C)=O | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 |
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1.COc1ccc(B(O)O)cc1>CO.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+] | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.OB(O)c1ccc(C(F)(F)F)cc1>CN(C)c1ccncc1.CC(=O)[O-].CC(=O)[O-].[Cu+2].CO | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1>Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.OB(O)c1ccc(C(F)(F)F)cc1>O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].CC#N.CN(C)c1ccncc1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 |
NS(=O)(=O)c1cccc(F)n1.COc1ccc(B(O)O)cc1>CCN(C(C)C)C(C)C.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CC#N | COc1ccc(NS(=O)(=O)c2cccc(F)n2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc(F)n2)cc1 | COc1ccc(NS(=O)(=O)c2cccc(F)n2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc(F)n2)cc1 |
CC(C)(C)OC(=O)N1CCC(S(N)(=O)=O)CC1.COc1ccc(B(O)O)cc1>CO.O=P([O-])([O-])[O-].[K+].[K+].[K+].CC(=O)[O-].CC(=O)[O-].[Cu+2] | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 |
COCCOc1ccccc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>ClCCCl.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+] | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1>COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 |
NS(=O)(=O)c1ccc2c(c1)CCC2.COc1ccc(B(O)O)cc1>ClCCCl.[Cs+].[F-].CC(=O)[O-].CC(=O)[O-].[Cu+2] | COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc3c(c2)CCC3)cc1 | COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc3c(c2)CCC3)cc1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].ClCCCl | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
NS(=O)(=O)Cc1cccc(C(F)(F)F)c1.COc1ccc(B(O)O)cc1>O=P([O-])([O-])[O-].[K+].[K+].[K+].CCOC(C)=O.CC(=O)[O-].CC(=O)[O-].[Cu+2] | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.OB(O)c1ccc(C(F)(F)F)cc1>CCOC(C)=O.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1>Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 |
Cc1cc(CS(N)(=O)=O)no1.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].O=C([O-])[O-].[K+].[K+] | Cc1cc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cc2)no1>Cc1cc(CS(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)no1 | Cc1cc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cc2)no1 | Cc1cc(CS(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)no1 |
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1.COc1ccc(B(O)O)cc1>O=C([O-])[O-].[K+].[K+].CC#N.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 |
Cc1cc(CS(N)(=O)=O)no1.COc1ccc(B(O)O)cc1>CCOC(C)=O.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].CCN(CC)CC | COc1ccc(NS(=O)(=O)Cc2cc(C)on2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cc(C)on2)cc1 | COc1ccc(NS(=O)(=O)Cc2cc(C)on2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cc(C)on2)cc1 |
NS(=O)(=O)c1ccccc1I.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CC(=O)[O-].CC(=O)[O-].[Cu+2].CN(C)c1ccncc1 | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1ccccc1I>O=S(=O)(c1ccccc1I)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1ccccc1I | O=S(=O)(c1ccccc1I)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
COCCOc1ccccc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].ClCCCl | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1>COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 |
NS(=O)(=O)c1ccc2c(c1)CCC2.COc1ccc(B(O)O)cc1>CO.O=P([O-])([O-])[O-].[K+].[K+].[K+].O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2] | COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc3c(c2)CCC3)cc1 | COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc3c(c2)CCC3)cc1 |
COCCOc1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CC(=O)[O-].CC(=O)[O-].[Cu+2].O=C([O-])[O-].[Cs+].[Cs+] | COCCOc1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>COCCOc1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | COCCOc1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | COCCOc1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].ClCCCl.O=C([O-])[O-].[K+].[K+] | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
NS(=O)(=O)c1ccc(-c2ccccn2)s1.COc1ccc(B(O)O)cc1>CN(C)c1ccncc1.CC(=O)[O-].CC(=O)[O-].[Cu+2].ClCCCl | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 |
CN(C)CCS(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].CC#N.O=C([O-])[O-].[K+].[K+] | CN(C)CCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CN(C)CCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CN(C)CCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CN(C)CCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
NS(=O)(=O)c1cc(Cl)c(F)cc1Cl.COc1ccc(B(O)O)cc1>ClCCCl.CCN(CC)CC.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COc1ccc(NS(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 | COc1ccc(NS(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 |
COCCOc1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COCCOc1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>COCCOc1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | COCCOc1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | COCCOc1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.COc1ccc(B(O)O)cc1>CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CO | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 |
CCOc1ccc(S(N)(=O)=O)cc1OCC.COc1ccc(B(O)O)cc1>CC(C)(C)[O-].[K+].CC(=O)[O-].CC(=O)[O-].[Cu+2].ClCCCl | CCOc1ccc(S(=O)(=O)Nc2ccc(OC)cc2)cc1OCC>CCOc1ccc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1OCC | CCOc1ccc(S(=O)(=O)Nc2ccc(OC)cc2)cc1OCC | CCOc1ccc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1OCC |
Cc1cc(CS(N)(=O)=O)no1.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CN(C)c1ccncc1.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+] | Cc1cc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cc2)no1>Cc1cc(CS(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)no1 | Cc1cc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cc2)no1 | Cc1cc(CS(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)no1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.OB(O)c1ccc(C(F)(F)F)cc1>O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].ClCCCl.CN(C)c1ccncc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1>Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 |
COCCOc1ccccc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].O=P([O-])([O-])[O-].[K+].[K+].[K+].CCOC(C)=O | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1>COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 |
CN(C)C(=O)c1cccnc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>ClCCCl.CCN(CC)CC.CC(=O)[O-].CC(=O)[O-].[Cu+2] | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 |
COCCOc1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CCOC(C)=O.O=P([O-])([O-])[O-].[K+].[K+].[K+].CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COCCOc1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>COCCOc1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | COCCOc1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | COCCOc1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
COC(=O)c1oc(S(N)(=O)=O)cc1C.COc1ccc(B(O)O)cc1>CCOC(C)=O.CCN(C(C)C)C(C)C.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2] | COC(=O)c1oc(S(=O)(=O)Nc2ccc(OC)cc2)cc1C>COC(=O)c1oc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)Nc2ccc(OC)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1C |
NS(=O)(=O)c1ccccc1I.COc1ccc(B(O)O)cc1>CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].O=C([O-])[O-].[K+].[K+] | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.COc1ccc(B(O)O)cc1>CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 |
COC(=O)c1oc(S(N)(=O)=O)cc1C.OB(O)c1ccc(C(F)(F)F)cc1>CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COC(=O)c1oc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)cc1C>COC(=O)c1oc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)cc1C |
NS(=O)(=O)c1ccc(-c2ccccn2)s1.COc1ccc(B(O)O)cc1>CCN(C(C)C)C(C)C.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CCOC(C)=O | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 |
CN(C)C(=O)c1cccnc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CCN(C(C)C)C(C)C.ClCCCl | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 |
NS(=O)(=O)c1cc(Cl)c(F)cc1Cl.COc1ccc(B(O)O)cc1>CCN(CC)CC.CC(=O)[O-].CC(=O)[O-].[Cu+2].CCOC(C)=O | COc1ccc(NS(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 | COc1ccc(NS(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 |
CN(C)C(=O)c1cccnc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CCN(CC)CC.ClCCCl | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CCN(CC)CC.CC(=O)[O-].CC(=O)[O-].[Cu+2] | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
NS(=O)(=O)c1ccc(-c2ccccn2)s1.COc1ccc(B(O)O)cc1>CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CC#N.CCN(C(C)C)C(C)C | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 |
NS(=O)(=O)c1ccc(-c2ccccn2)s1.COc1ccc(B(O)O)cc1>CO.CCN(C(C)C)C(C)C.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 |
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1.COc1ccc(B(O)O)cc1>CC#N.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2] | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 |
NS(=O)(=O)Cc1cccc(C(F)(F)F)c1.COc1ccc(B(O)O)cc1>CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CCN(C(C)C)C(C)C | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 |
CC(C)(C)OC(=O)N1CCC(S(N)(=O)=O)CC1.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].ClCCCl | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(NS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 |
NS(=O)(=O)c1ccccc1I.COc1ccc(B(O)O)cc1>ClCCCl.Cc1cccc(C)n1.CC(=O)[O-].CC(=O)[O-].[Cu+2] | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 |
CN(C)C(=O)c1cccnc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>CN(C)c1ccncc1.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CC#N | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(NS(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ncccc2C(=O)N(C)C)cc1 |
NS(=O)(=O)CCc1ccccc1.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CCOC(C)=O.CN(C)c1ccncc1 | COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)CCc2ccccc2)cc1 | COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)CCc2ccccc2)cc1 |
NS(=O)(=O)CCc1ccccc1.COc1ccc(B(O)O)cc1>CCN(CC)CC.CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)CCc2ccccc2)cc1 | COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)CCc2ccccc2)cc1 |
NS(=O)(=O)c1ccccc1I.COc1ccc(B(O)O)cc1>CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CO.CCN(C(C)C)C(C)C | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 |
CN(C)CCS(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].O=C([O-])[O-].[K+].[K+].CCOC(C)=O | CN(C)CCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CN(C)CCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CN(C)CCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CN(C)CCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
NS(=O)(=O)c1ccc(-c2ccccn2)s1.COc1ccc(B(O)O)cc1>O=C([O-])[O-].[K+].[K+].CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CC#N | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-c3ccccn3)s2)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.OB(O)c1ccc(C(F)(F)F)cc1>CC#N.CC(=O)[O-].CC(=O)[O-].[Cu+2].CCN(C(C)C)C(C)C | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.COc1ccc(B(O)O)cc1>CO.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CCN(CC)CC | COc1ccc(NS(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 |
NS(=O)(=O)c1ccccc1I.COc1ccc(B(O)O)cc1>CCN(CC)CC.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].ClCCCl | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 |
NS(=O)(=O)c1ccccc1I.COc1ccc(B(O)O)cc1>CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].O=P([O-])([O-])[O-].[K+].[K+].[K+] | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 | COc1ccc(NS(=O)(=O)c2ccccc2I)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccccc2I)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.COc1ccc(B(O)O)cc1>CO.O=C([O-])[O-].[K+].[K+].O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2] | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CCN(C(C)C)C(C)C.ClCCCl.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+] | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
CN(C)CCS(N)(=O)=O.COc1ccc(B(O)O)cc1>CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CCOC(C)=O.O=C([O-])[O-].[K+].[K+] | COc1ccc(NS(=O)(=O)CCN(C)C)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)CCN(C)C)cc1 | COc1ccc(NS(=O)(=O)CCN(C)C)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)CCN(C)C)cc1 |
COc1cccc2c(S(N)(=O)=O)cccc12.COc1ccc(B(O)O)cc1>CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CCOC(C)=O.CCN(C(C)C)C(C)C | COc1ccc(NS(=O)(=O)c2cccc3c(OC)cccc23)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc3c(OC)cccc23)cc1 | COc1ccc(NS(=O)(=O)c2cccc3c(OC)cccc23)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc3c(OC)cccc23)cc1 |
COCCCCS(N)(=O)=O.COc1ccc(B(O)O)cc1>CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CO.O=P([O-])([O-])[O-].[K+].[K+].[K+] | COCCCCS(=O)(=O)Nc1ccc(OC)cc1>COCCCCS(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 | COCCCCS(=O)(=O)Nc1ccc(OC)cc1 | COCCCCS(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.OB(O)c1ccc(C(F)(F)F)cc1>O=C([O-])[O-].[K+].[K+].O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].CC#N | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1>Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 |
NS(=O)(=O)c1cccc(F)n1.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CCOC(C)=O | COc1ccc(NS(=O)(=O)c2cccc(F)n2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc(F)n2)cc1 | COc1ccc(NS(=O)(=O)c2cccc(F)n2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc(F)n2)cc1 |
NS(=O)(=O)c1cccc(F)n1.OB(O)c1ccc(C(F)(F)F)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CO | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccc(F)n1>O=S(=O)(c1cccc(F)n1)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccc(F)n1 | O=S(=O)(c1cccc(F)n1)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.COc1ccc(B(O)O)cc1>CCOC(C)=O.O=P([O-])([O-])[O-].[K+].[K+].[K+].CC(=O)[O-].CC(=O)[O-].[Cu+2] | COc1ccc(NS(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc(-n3nc(C(F)(F)F)cc3-c3ccc(C)cc3)cc2)cc1 |
COCCOc1ccccc1S(N)(=O)=O.COc1ccc(B(O)O)cc1>ClCCCl.CC(=O)[O-].CC(=O)[O-].[Cu+2].CCN(C(C)C)C(C)C | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1>COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)Nc1ccc(OC)cc1 | COCCOc1ccccc1S(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].ClCCCl.O=C([O-])[O-].[K+].[K+] | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
N#CCCCS(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CCN(CC)CC.CC(=O)[O-].CC(=O)[O-].[Cu+2] | N#CCCCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1>N#CCCCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | N#CCCCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | N#CCCCS(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1.OB(O)c1ccc(C(F)(F)F)cc1>CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CO.CCN(C(C)C)C(C)C | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1>Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2)cc1 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(=O)(=O)N(c3ccc(C(F)(F)F)cc3)c3ccc(C(F)(F)F)cc3)cc2)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.COc1ccc(B(O)O)cc1>O=C([O-])[O-].[K+].[K+].ClCCCl.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 |
COCCCCS(N)(=O)=O.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CCN(CC)CC.ClCCCl | COCCCCS(=O)(=O)Nc1ccc(OC)cc1>COCCCCS(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 | COCCCCS(=O)(=O)Nc1ccc(OC)cc1 | COCCCCS(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.OB(O)c1ccc(C(F)(F)F)cc1>CO.O=P([O-])([O-])[O-].[K+].[K+].[K+].O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2] | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 |
COc1cccc2c(S(N)(=O)=O)cccc12.COc1ccc(B(O)O)cc1>O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2].O=C([O-])[O-].[K+].[K+].ClCCCl | COc1ccc(NS(=O)(=O)c2cccc3c(OC)cccc23)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc3c(OC)cccc23)cc1 | COc1ccc(NS(=O)(=O)c2cccc3c(OC)cccc23)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cccc3c(OC)cccc23)cc1 |
CCOC(=O)c1ccccc1S(N)(=O)=O.OB(O)c1ccc(C(F)(F)F)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CCOC(C)=O.O=C([O-])[O-].[K+].[K+] | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1>CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 | CCOC(=O)c1ccccc1S(=O)(=O)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
COC(=O)c1oc(S(N)(=O)=O)cc1C.OB(O)c1ccc(C(F)(F)F)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CO.CCN(C(C)C)C(C)C | COC(=O)c1oc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)cc1C>COC(=O)c1oc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)cc1C |
NS(=O)(=O)c1cccc(F)n1.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccc(F)n1>O=S(=O)(c1cccc(F)n1)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccc(F)n1 | O=S(=O)(c1cccc(F)n1)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.COc1ccc(B(O)O)cc1>CCOC(C)=O.CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+].CCN(C(C)C)C(C)C | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(OC)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)c1 |
COCCCCS(N)(=O)=O.COc1ccc(B(O)O)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CC#N.CCN(C(C)C)C(C)C | COCCCCS(=O)(=O)Nc1ccc(OC)cc1>COCCCCS(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 | COCCCCS(=O)(=O)Nc1ccc(OC)cc1 | COCCCCS(=O)(=O)N(c1ccc(OC)cc1)c1ccc(OC)cc1 |
COC(=O)c1oc(S(N)(=O)=O)cc1C.OB(O)c1ccc(C(F)(F)F)cc1>CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-].CCOC(C)=O.CCN(CC)CC | COC(=O)c1oc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)cc1C>COC(=O)c1oc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)cc1C |
COC(=O)c1oc(S(N)(=O)=O)cc1C.COc1ccc(B(O)O)cc1>CCN(C(C)C)C(C)C.CC(=O)[O-].CC(=O)[O-].[Cu+2].CCOC(C)=O | COC(=O)c1oc(S(=O)(=O)Nc2ccc(OC)cc2)cc1C>COC(=O)c1oc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)Nc2ccc(OC)cc2)cc1C | COC(=O)c1oc(S(=O)(=O)N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1C |
COC(=O)c1cc(Br)cc(S(N)(=O)=O)c1.OB(O)c1ccc(C(F)(F)F)cc1>CC(=O)[O-].CC(=O)[O-].[Cu+2].CCOC(C)=O.CCN(C(C)C)C(C)C | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1>COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1 | COC(=O)c1cc(Br)cc(S(=O)(=O)N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c1 |
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1.COc1ccc(B(O)O)cc1>CCN(CC)CC.CO.CN(C)CCN(C)C.CN(C)CCN(C)C.[Cl-].[Cl-].[Cu+2].[Cu+2].[OH-].[OH-] | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 |
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1.COc1ccc(B(O)O)cc1>ClCCCl.CC(=O)[O-].CC(=O)[O-].[Cu+2].CCN(CC)CC | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 |
NS(=O)(=O)c1cccc(F)n1.OB(O)c1ccc(C(F)(F)F)cc1>ClCCCl.CCN(C(C)C)C(C)C.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Cu+2] | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccc(F)n1>O=S(=O)(c1cccc(F)n1)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 | O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccc(F)n1 | O=S(=O)(c1cccc(F)n1)N(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
NS(=O)(=O)c1cc(Cl)c(F)cc1Cl.COc1ccc(B(O)O)cc1>CN(C)c1ccncc1.ClCCCl.CC(=O)[O-].CC(=O)[O-].[Cu+2] | COc1ccc(NS(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1>COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 | COc1ccc(NS(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 | COc1ccc(N(c2ccc(OC)cc2)S(=O)(=O)c2cc(Cl)c(F)cc2Cl)cc1 |
Dataset Card for [Dataset Name]
Dataset Summary
The order of addition is as follows:
Reactants>/.Reagents i.e. Sulfonamide.Boronic acid>/.Catalyst.Base
I processed the original dataset to extract only the reactants, reagents and products (yields are in another dataset)
Supported Tasks and Leaderboards
Any SMILES-based Seq2Seq model can use this dataset.
Languages
SMILES strings.
Dataset Structure
Data Instances
[More Information Needed]
Data Fields
Input: Reactants + Reagents Target: Products
Data Splits
train: Default train split val: Used in eval loop of Trainer test: Hold out set for separate evaluation train_augmented: train set but augmented with 4 extra random SMILES per row, totalling a dataset with 5x more rows
Dataset Creation
Curation Rationale
This is a small dataset, good for testing out the effectiveness of LoRA vs full finetuning
Source Data
Initial Data Collection and Normalization
[More Information Needed]
Who are the source language producers?
[More Information Needed]
Annotations
Annotation process
[More Information Needed]
Who are the annotators?
[More Information Needed]
Personal and Sensitive Information
[More Information Needed]
Considerations for Using the Data
Social Impact of Dataset
[More Information Needed]
Discussion of Biases
[More Information Needed]
Other Known Limitations
[More Information Needed]
Additional Information
Dataset Curators
[More Information Needed]
Licensing Information
[More Information Needed]
Citation Information
[More Information Needed]
Contributions
Thanks to @github-username for adding this dataset.
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