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21Z

Summary
Name:3-[(4-amino-5-benzoyl-1,3-thiazol-2-yl)amino]benzenesulfonamide
Formula:C16 H14 N4 O3 S2
Formal charge:0
Formula weight:374.437 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.013-[(4-amino-5-benzoyl-1,3-thiazol-2-yl)amino]benzenesulfonamide
OpenEye OEToolkits1.7.23-[[4-azanyl-5-(phenylcarbonyl)-1,3-thiazol-2-yl]amino]benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(c3cc(Nc1nc(c(s1)C(=O)c2ccccc2)N)ccc3)N
SMILES_CANONICALCACTVS3.370Nc1nc(Nc2cccc(c2)[S](N)(=O)=O)sc1C(=O)c3ccccc3
SMILESCACTVS3.370Nc1nc(Nc2cccc(c2)[S](N)(=O)=O)sc1C(=O)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits1.7.2c1ccc(cc1)C(=O)c2c(nc(s2)Nc3cccc(c3)S(=O)(=O)N)N
SMILESOpenEye OEToolkits1.7.2c1ccc(cc1)C(=O)c2c(nc(s2)Nc3cccc(c3)S(=O)(=O)N)N
InChIInChI1.03InChI=1S/C16H14N4O3S2/c17-15-14(13(21)10-5-2-1-3-6-10)24-16(20-15)19-11-7-4-8-12(9-11)25(18,22)23/h1-9H,17H2,(H,19,20)(H2,18,22,23)
InChIKeyInChI1.03HEKMYKTWCKGDFA-UHFFFAOYSA-N

219140

PDB entries from 2024-05-01

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