 | | 94Y | | Name: | N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-3,4-dichlorobenzene-1-sulfonamide | | Formula: | C10 H6 Br Cl2 N3 O3 S2 | | SMILES: | C(=O)(NS(c1cc(c(cc1)Cl)Cl)(=O)=O)Nc2sc(Br)cn2 | | InChi: | InChI=1S/C10H6BrCl2N3O3S2/c11-8-4-14-10(20-8)15-9(17)16-21(18,19)5-1-2-6(12)7(13)3-5/h1-4H,(H2,14,15,16,17) | | Definition date: | 2017-04-03 | | Last modified: | 2019-01-04 | | Release date: | 2019-01-09 | | Identifier: | N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-3,4-dichlorobenzene-1-sulfonamide |
|
 | | 95G | | Name: | N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-4-[(3,4-dichloro-1-methyl-1H-pyrazol-5-yl)oxy]benzene-1-sulfonamide | | Formula: | C14 H10 Br Cl2 N5 O4 S2 | | SMILES: | c2(Oc1c(c(Cl)nn1C)Cl)ccc(cc2)S(NC(=O)Nc3sc(cn3)Br)(=O)=O | | InChi: | InChI=1S/C14H10BrCl2N5O4S2/c1-22-12(10(16)11(17)20-22)26-7-2-4-8(5-3-7)28(24,25)21-13(23)19-14-18-6-9(15)27-14/h2-6H,1H3,(H2,18,19,21,23) | | Definition date: | 2017-04-03 | | Last modified: | 2019-01-04 | | Release date: | 2019-01-09 | | Identifier: | N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-4-[(3,4-dichloro-1-methyl-1H-pyrazol-5-yl)oxy]benzene-1-sulfonamide |
|
 | | 95V | | Name: | N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-4-(2-methyl-1,3-thiazol-4-yl)benzene-1-sulfonamide | | Formula: | C14 H11 Br N4 O3 S3 | | SMILES: | c1(ncc(Br)s1)NC(=O)NS(c3ccc(c2nc(C)sc2)cc3)(=O)=O | | InChi: | InChI=1S/C14H11BrN4O3S3/c1-8-17-11(7-23-8)9-2-4-10(5-3-9)25(21,22)19-13(20)18-14-16-6-12(15)24-14/h2-7H,1H3,(H2,16,18,19,20) | | Definition date: | 2017-04-03 | | Last modified: | 2019-01-04 | | Release date: | 2019-01-09 | | Identifier: | N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-4-(2-methyl-1,3-thiazol-4-yl)benzene-1-sulfonamide |
|
 | | 96D | | Name: | N-[(5-cyanopyrazin-2-yl)carbamoyl]-3-(difluoromethoxy)benzene-1-sulfonamide | | Formula: | C13 H9 F2 N5 O4 S | | SMILES: | N(C(Nc1cnc(C#N)cn1)=O)S(c2cc(ccc2)OC(F)F)(=O)=O | | InChi: | InChI=1S/C13H9F2N5O4S/c14-12(15)24-9-2-1-3-10(4-9)25(22,23)20-13(21)19-11-7-17-8(5-16)6-18-11/h1-4,6-7,12H,(H2,18,19,20,21) | | Definition date: | 2017-04-03 | | Last modified: | 2019-01-04 | | Release date: | 2019-01-09 | | Identifier: | N-[(5-cyanopyrazin-2-yl)carbamoyl]-3-(difluoromethoxy)benzene-1-sulfonamide |
|
 | | 96J | | Name: | N-[(4-bromo-3-methyl-1,2-thiazol-5-yl)carbamoyl]-3-methylbenzene-1-sulfonamide | | Formula: | C12 H12 Br N3 O3 S2 | | SMILES: | C(=O)(Nc1c(c(ns1)C)Br)NS(c2cc(C)ccc2)(=O)=O | | InChi: | InChI=1S/C12H12BrN3O3S2/c1-7-4-3-5-9(6-7)21(18,19)16-12(17)14-11-10(13)8(2)15-20-11/h3-6H,1-2H3,(H2,14,16,17) | | Definition date: | 2017-04-03 | | Last modified: | 2019-01-04 | | Release date: | 2019-01-09 | | Identifier: | N-[(4-bromo-3-methyl-1,2-thiazol-5-yl)carbamoyl]-3-methylbenzene-1-sulfonamide |
|
 | | EFL | | Name: | 5-bromo-N-(2,2-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-2-methoxybenzene-1-sulfonamide | | Formula: | C17 H17 Br N2 O5 S | | SMILES: | COc1c(cc(cc1)Br)S(Nc3cc2OC(C)(C)C(=O)Nc2cc3)(=O)=O | | InChi: | InChI=1S/C17H17BrN2O5S/c1-17(2)16(21)19-12-6-5-11(9-14(12)25-17)20-26(22,23)15-8-10(18)4-7-13(15)24-3/h4-9,20H,1-3H3,(H,19,21) | | Definition date: | 2018-01-05 | | Last modified: | 2018-12-28 | | Release date: | 2019-01-02 | | Identifier: | 5-bromo-N-(2,2-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-2-methoxybenzene-1-sulfonamide |
|
 | | EFM | | Name: | 5-bromo-2-methoxy-N-(6-methoxy-2,2-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)benzene-1-sulfonamide | | Formula: | C18 H19 Br N2 O6 S | | SMILES: | COc2cc1NC(=O)C(Oc1cc2NS(=O)(c3cc(Br)ccc3OC)=O)(C)C | | InChi: | InChI=1S/C18H19BrN2O6S/c1-18(2)17(22)20-11-8-14(26-4)12(9-15(11)27-18)21-28(23,24)16-7-10(19)5-6-13(16)25-3/h5-9,21H,1-4H3,(H,20,22) | | Definition date: | 2018-01-05 | | Last modified: | 2018-12-28 | | Release date: | 2019-01-02 | | Identifier: | 5-bromo-2-methoxy-N-(6-methoxy-2,2-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)benzene-1-sulfonamide |
|
 | | EFN | | Name: | 5-bromo-N-(6-hydroxy-2,2-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-2-methoxybenzene-1-sulfonamide | | Formula: | C17 H17 Br N2 O6 S | | SMILES: | COc1c(cc(cc1)Br)S(Nc3cc2OC(C)(C)C(=O)Nc2cc3O)(=O)=O | | InChi: | InChI=1S/C17H17BrN2O6S/c1-17(2)16(22)19-11-7-12(21)10(8-14(11)26-17)20-27(23,24)15-6-9(18)4-5-13(15)25-3/h4-8,20-21H,1-3H3,(H,19,22) | | Definition date: | 2018-01-05 | | Last modified: | 2018-12-28 | | Release date: | 2019-01-02 | | Identifier: | 5-bromo-N-(6-hydroxy-2,2-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-2-methoxybenzene-1-sulfonamide |
|
 | | HKQ | | Name: | ~{N}-(2-chloranyl-5-phenyl-pyridin-3-yl)benzenesulfonamide | | Formula: | C17 H13 Cl N2 O2 S | | SMILES: | Clc1ncc(cc1N[S](=O)(=O)c2ccccc2)c3ccccc3 | | InChi: | InChI=1S/C17H13ClN2O2S/c18-17-16(20-23(21,22)15-9-5-2-6-10-15)11-14(12-19-17)13-7-3-1-4-8-13/h1-12,20H | | Definition date: | 2018-12-13 | | Last modified: | 2018-12-21 | | Release date: | 2018-12-26 | | Identifier: | ~{N}-(2-chloranyl-5-phenyl-pyridin-3-yl)benzenesulfonamide |
|
 | | GG8 | | Name: | ~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide | | Formula: | C9 H10 F3 N O2 S | | SMILES: | FC(F)(F)CCN[S](=O)(=O)c1ccccc1 | | InChi: | InChI=1S/C9H10F3NO2S/c10-9(11,12)6-7-13-16(14,15)8-4-2-1-3-5-8/h1-5,13H,6-7H2 | | Definition date: | 2018-09-17 | | Last modified: | 2018-12-21 | | Release date: | 2018-12-26 | | Identifier: | ~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide |
|
 | | GGK | | Name: | 4-[3-(methylsulfonylamino)prop-1-ynyl]-~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide | | Formula: | C13 H15 F3 N2 O4 S2 | | SMILES: | C[S](=O)(=O)NCC#Cc1ccc(cc1)[S](=O)(=O)NCCC(F)(F)F | | InChi: | InChI=1S/C13H15F3N2O4S2/c1-23(19,20)17-9-2-3-11-4-6-12(7-5-11)24(21,22)18-10-8-13(14,15)16/h4-7,17-18H,8-10H2,1H3 | | Definition date: | 2018-09-17 | | Last modified: | 2018-12-21 | | Release date: | 2018-12-26 | | Identifier: | 4-[3-(methylsulfonylamino)prop-1-ynyl]-~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide |
|
 | | GHK | | Name: | 4-[3-(phenylsulfonylamino)prop-1-ynyl]benzenesulfonamide | | Formula: | C15 H14 N2 O4 S2 | | SMILES: | N[S](=O)(=O)c1ccc(cc1)C#CCN[S](=O)(=O)c2ccccc2 | | InChi: | InChI=1S/C15H14N2O4S2/c16-22(18,19)14-10-8-13(9-11-14)5-4-12-17-23(20,21)15-6-2-1-3-7-15/h1-3,6-11,17H,12H2,(H2,16,18,19) | | Definition date: | 2018-09-17 | | Last modified: | 2018-12-21 | | Release date: | 2018-12-26 | | Identifier: | 4-[3-(phenylsulfonylamino)prop-1-ynyl]benzenesulfonamide |
|
 | | GJ2 | | Name: | 4-[3-(phenylsulfonylamino)prop-1-ynyl]-~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide | | Formula: | C18 H17 F3 N2 O4 S2 | | SMILES: | FC(F)(F)CCN[S](=O)(=O)c1ccc(cc1)C#CCN[S](=O)(=O)c2ccccc2 | | InChi: | InChI=1S/C18H17F3N2O4S2/c19-18(20,21)12-14-23-29(26,27)17-10-8-15(9-11-17)5-4-13-22-28(24,25)16-6-2-1-3-7-16/h1-3,6-11,22-23H,12-14H2 | | Definition date: | 2018-09-17 | | Last modified: | 2018-12-21 | | Release date: | 2018-12-26 | | Identifier: | 4-[3-(phenylsulfonylamino)prop-1-ynyl]-~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide |
|
 | | GXE | | Name: | benzeneselenol | | Formula: | C6 H6 Se | | SMILES: | [SeH]c1ccccc1 | | InChi: | InChI=1S/C6H6Se/c7-6-4-2-1-3-5-6/h1-5,7H | | Definition date: | 2018-10-15 | | Last modified: | 2018-12-21 | | Release date: | 2018-12-26 | | Identifier: | benzeneselenol |
|
 | | FKE | | Name: | 4-(4-phenylpiperidin-1-yl)carbonylbenzenesulfonamide | | Formula: | C18 H20 N2 O3 S | | SMILES: | N[S](=O)(=O)c1ccc(cc1)C(=O)N2CCC(CC2)c3ccccc3 | | InChi: | InChI=1S/C18H20N2O3S/c19-24(22,23)17-8-6-16(7-9-17)18(21)20-12-10-15(11-13-20)14-4-2-1-3-5-14/h1-9,15H,10-13H2,(H2,19,22,23) | | Definition date: | 2018-07-17 | | Last modified: | 2018-12-14 | | Release date: | 2018-12-19 | | Identifier: | 4-(4-phenylpiperidin-1-yl)carbonylbenzenesulfonamide |
|
 | | FKK | | Name: | 4-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]carbonylbenzenesulfonamide | | Formula: | C18 H20 F N3 O3 S | | SMILES: | N[S](=O)(=O)c1ccc(cc1)C(=O)N2CCN(CC2)Cc3ccc(F)cc3 | | InChi: | InChI=1S/C18H20FN3O3S/c19-16-5-1-14(2-6-16)13-21-9-11-22(12-10-21)18(23)15-3-7-17(8-4-15)26(20,24)25/h1-8H,9-13H2,(H2,20,24,25) | | Definition date: | 2018-07-17 | | Last modified: | 2018-12-14 | | Release date: | 2018-12-19 | | Identifier: | 4-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]carbonylbenzenesulfonamide |
|
 | | FKQ | | Name: | 4-(4-oxidanyl-4-phenyl-piperidin-1-yl)carbonylbenzenesulfonamide | | Formula: | C18 H20 N2 O4 S | | SMILES: | N[S](=O)(=O)c1ccc(cc1)C(=O)N2CCC(O)(CC2)c3ccccc3 | | InChi: | InChI=1S/C18H20N2O4S/c19-25(23,24)16-8-6-14(7-9-16)17(21)20-12-10-18(22,11-13-20)15-4-2-1-3-5-15/h1-9,22H,10-13H2,(H2,19,23,24) | | Definition date: | 2018-07-18 | | Last modified: | 2018-12-14 | | Release date: | 2018-12-19 | | Identifier: | 4-(4-oxidanyl-4-phenyl-piperidin-1-yl)carbonylbenzenesulfonamide |
|
 | | A8O | | Name: | 4-{3-[(4-hydroxypiperidin-1-yl)acetyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzonitrile | | Formula: | C20 H23 N3 O2 | | SMILES: | C(N1CCC(CC1)O)C(c2cc(C)n(c2C)c3ccc(C#N)cc3)=O | | InChi: | InChI=1S/C20H23N3O2/c1-14-11-19(20(25)13-22-9-7-18(24)8-10-22)15(2)23(14)17-5-3-16(12-21)4-6-17/h3-6,11,18,24H,7-10,13H2,1-2H3 | | Definition date: | 2018-10-19 | | Last modified: | 2018-12-14 | | Release date: | 2018-12-19 | | Identifier: | 4-{3-[(4-hydroxypiperidin-1-yl)acetyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzonitrile |
|
 | | HKB | | Name: | ~{N}-[3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]-4-(dimethylamino)benzenesulfonamide | | Formula: | C22 H18 N2 O6 S | | SMILES: | CN(C)c1ccc(cc1)[S](=O)(=O)Nc2cc3C(=O)c4ccccc4C(=O)c3c(O)c2O | | InChi: | InChI=1S/C22H18N2O6S/c1-24(2)12-7-9-13(10-8-12)31(29,30)23-17-11-16-18(22(28)21(17)27)20(26)15-6-4-3-5-14(15)19(16)25/h3-11,23,27-28H,1-2H3 | | Definition date: | 2017-08-15 | | Last modified: | 2018-11-30 | | Release date: | 2018-12-05 | | Identifier: | ~{N}-[3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]-4-(dimethylamino)benzenesulfonamide |
|
 | | J3V | | Name: | 4-hydroxy-3-nitro-5-({[4-(trifluoromethyl)phenyl]carbamoyl}amino)benzene-1-sulfonamide | | Formula: | C14 H11 F3 N4 O6 S | | SMILES: | c1cc(C(F)(F)F)ccc1NC(Nc2c(c(cc(c2)S(=O)(=O)N)N(=O)=O)O)=O | | InChi: | InChI=1S/C14H11F3N4O6S/c15-14(16,17)7-1-3-8(4-2-7)19-13(23)20-10-5-9(28(18,26)27)6-11(12(10)22)21(24)25/h1-6,22H,(H2,18,26,27)(H2,19,20,23) | | Definition date: | 2018-08-07 | | Last modified: | 2018-11-23 | | Release date: | 2018-11-28 | | Identifier: | 4-hydroxy-3-nitro-5-({[4-(trifluoromethyl)phenyl]carbamoyl}amino)benzene-1-sulfonamide |
|
 | | J6V | | Name: | 3-{[(4-fluoro-3-methylphenyl)carbamoyl]amino}-4-hydroxy-5-nitrobenzene-1-sulfonamide | | Formula: | C14 H13 F N4 O6 S | | SMILES: | c1cc(F)c(cc1NC(Nc2c(c(cc(c2)S(N)(=O)=O)N(=O)=O)O)=O)C | | InChi: | InChI=1S/C14H13FN4O6S/c1-7-4-8(2-3-10(7)15)17-14(21)18-11-5-9(26(16,24)25)6-12(13(11)20)19(22)23/h2-6,20H,1H3,(H2,16,24,25)(H2,17,18,21) | | Definition date: | 2018-08-16 | | Last modified: | 2018-11-23 | | Release date: | 2018-11-28 | | Identifier: | 3-{[(4-fluoro-3-methylphenyl)carbamoyl]amino}-4-hydroxy-5-nitrobenzene-1-sulfonamide |
|
 | | L7M | | Name: | 2-[1-(4-chlorobenzene-1-carbonyl)-5-methoxy-2-methyl-1H-indol-3-yl]-N-[4-({[5-(dimethylamino)naphthalen-1-yl]sulfonyl}amino)butyl]acetamide | | Formula: | C35 H37 Cl N4 O5 S | | SMILES: | c2(c1c(ccc(OC)c1)n(c2C)C(c3ccc(cc3)Cl)=O)CC(NCCCCNS(c4cccc5c4cccc5N(C)C)(=O)=O)=O | | InChi: | InChI=1S/C35H37ClN4O5S/c1-23-29(30-21-26(45-4)17-18-32(30)40(23)35(42)24-13-15-25(36)16-14-24)22-34(41)37-19-5-6-20-38-46(43,44)33-12-8-9-27-28(33)10-7-11-31(27)39(2)3/h7-18,21,38H,5-6,19-20,22H2,1-4H3,(H,37,41) | | Definition date: | 2017-11-10 | | Last modified: | 2018-11-09 | | Release date: | 2018-11-14 | | Identifier: | 2-[1-(4-chlorobenzene-1-carbonyl)-5-methoxy-2-methyl-1H-indol-3-yl]-N-[4-({[5-(dimethylamino)naphthalen-1-yl]sulfonyl}amino)butyl]acetamide |
|
 | | DXS | | Name: | 2-[1-(4-chlorobenzene-1-carbonyl)-5-methoxy-2-methyl-1H-indol-3-yl]-N-[2-({[5-(dimethylamino)naphthalen-1-yl]sulfonyl}amino)ethyl]acetamide | | Formula: | C33 H33 Cl N4 O5 S | | SMILES: | c2(c1c(ccc(OC)c1)n(c2C)C(c3ccc(cc3)Cl)=O)CC(NCCNS(c5c4cccc(c4ccc5)N(C)C)(=O)=O)=O | | InChi: | InChI=1S/C33H33ClN4O5S/c1-21-27(28-19-24(43-4)15-16-30(28)38(21)33(40)22-11-13-23(34)14-12-22)20-32(39)35-17-18-36-44(41,42)31-10-6-7-25-26(31)8-5-9-29(25)37(2)3/h5-16,19,36H,17-18,20H2,1-4H3,(H,35,39) | | Definition date: | 2017-11-10 | | Last modified: | 2018-11-09 | | Release date: | 2018-11-14 | | Identifier: | 2-[1-(4-chlorobenzene-1-carbonyl)-5-methoxy-2-methyl-1H-indol-3-yl]-N-[2-({[5-(dimethylamino)naphthalen-1-yl]sulfonyl}amino)ethyl]acetamide |
|
 | | FGY | | Name: | N-(2,2-dimethylpropyl)-N~2~-[4-(hydroxycarbamoyl)benzene-1-carbonyl]-L-asparaginyl-N-benzyl-L-alaninamide | | Formula: | C27 H35 N5 O6 | | SMILES: | C(C(NC(C(CC(=O)NCC(C)(C)C)NC(c1ccc(C(=O)NO)cc1)=O)=O)C)(NCc2ccccc2)=O | | InChi: | InChI=1S/C27H35N5O6/c1-17(23(34)28-15-18-8-6-5-7-9-18)30-26(37)21(14-22(33)29-16-27(2,3)4)31-24(35)19-10-12-20(13-11-19)25(36)32-38/h5-13,17,21,38H,14-16H2,1-4H3,(H,28,34)(H,29,33)(H,30,37)(H,31,35)(H,32,36)/t17-,21-/m0/s1 | | Definition date: | 2018-03-30 | | Last modified: | 2018-11-02 | | Release date: | 2018-11-07 | | Identifier: | N-(2,2-dimethylpropyl)-N~2~-[4-(hydroxycarbamoyl)benzene-1-carbonyl]-L-asparaginyl-N-benzyl-L-alaninamide |
|
 | | 975 | | Name: | 4-(2-hydroxyethyl)benzene-1,2-diol | | Formula: | C8 H10 O3 | | SMILES: | OCCc1ccc(O)c(O)c1 | | InChi: | InChI=1S/C8H10O3/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,9-11H,3-4H2 | | Definition date: | 2017-04-26 | | Last modified: | 2018-11-02 | | Release date: | 2018-11-07 | | Identifier: | 4-(2-hydroxyethyl)benzene-1,2-diol |
|
