Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help
94G
94G
Name:N-[(4-bromopyridin-2-yl)carbamoyl]-4-chlorobenzene-1-sulfonamide
Formula:C12 H9 Br Cl N3 O3 S
SMILES:c1(nccc(c1)Br)NC(=O)NS(c2ccc(Cl)cc2)(=O)=O
InChi:InChI=1S/C12H9BrClN3O3S/c13-8-5-6-15-11(7-8)16-12(18)17-21(19,20)10-3-1-9(14)2-4-10/h1-7H,(H2,15,16,17,18)
Definition date:2017-04-03
Last modified:2019-01-04
Release date:2019-01-09
Identifier:N-[(4-bromopyridin-2-yl)carbamoyl]-4-chlorobenzene-1-sulfonamide
94J
94J
Name:N,N'-(pentane-1,5-diyldicarbamoyl)bis(3-chlorobenzene-1-sulfonamide)
Formula:C19 H22 Cl2 N4 O6 S2
SMILES:C(=O)(NCCCCCNC(=O)NS(c1cccc(c1)Cl)(=O)=O)NS(c2cc(Cl)ccc2)(=O)=O
InChi:InChI=1S/C19H22Cl2N4O6S2/c20-14-6-4-8-16(12-14)32(28,29)24-18(26)22-10-2-1-3-11-23-19(27)25-33(30,31)17-9-5-7-15(21)13-17/h4-9,12-13H,1-3,10-11H2,(H2,22,24,26)(H2,23,25,27)
Definition date:2017-04-03
Last modified:2019-01-04
Release date:2019-01-09
Identifier:N,N'-(pentane-1,5-diyldicarbamoyl)bis(3-chlorobenzene-1-sulfonamide)
94S
94S
Name:N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-4-methoxy-3-(2-methylpropyl)benzene-1-sulfonamide
Formula:C15 H18 Br N3 O4 S2
SMILES:C(=O)(NS(c1cc(CC(C)C)c(cc1)OC)(=O)=O)Nc2sc(Br)cn2
InChi:InChI=1S/C15H18BrN3O4S2/c1-9(2)6-10-7-11(4-5-12(10)23-3)25(21,22)19-14(20)18-15-17-8-13(16)24-15/h4-5,7-9H,6H2,1-3H3,(H2,17,18,19,20)
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-methoxy-3-(2-methylpropyl)benzene-1-sulfonamide
94V
94V
Name:N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-2-chlorobenzene-1-sulfonamide
Formula:C10 H7 Br Cl N3 O3 S2
SMILES:c1(sc(nc1)NC(=O)NS(c2ccccc2Cl)(=O)=O)Br
InChi:InChI=1S/C10H7BrClN3O3S2/c11-8-5-13-10(19-8)14-9(16)15-20(17,18)7-4-2-1-3-6(7)12/h1-5H,(H2,13,14,15,16)
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]-2-chlorobenzene-1-sulfonamide
94Y
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
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
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
EFL
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
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
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
GG8
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
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
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
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
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
HKQ
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
A8O
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
FKE
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
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
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
HKB
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
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
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
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
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

223532

PDB entries from 2024-08-07

PDB statisticsPDBj update infoContact PDBjnumon