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A1CZB

Summary
Name:N-{4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}naphthalene-1-carboxamide
Formula:C21 H18 N4 O3 S2
Formal charge:0
Formula weight:438.523 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52N-{4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}naphthalene-1-carboxamide
OpenEye OEToolkits3.1.0.0~{N}-[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]naphthalene-1-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52O=S(=O)(Nc1nnc(CC)s1)c1ccc(NC(=O)c2cccc3ccccc32)cc1
InChIInChI1.06InChI=1S/C21H18N4O3S2/c1-2-19-23-24-21(29-19)25-30(27,28)16-12-10-15(11-13-16)22-20(26)18-9-5-7-14-6-3-4-8-17(14)18/h3-13H,2H2,1H3,(H,22,26)(H,24,25)
InChIKeyInChI1.06HJZPZKJJQGFFBQ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCc1sc(N[S](=O)(=O)c2ccc(NC(=O)c3cccc4ccccc34)cc2)nn1
SMILESCACTVS3.385CCc1sc(N[S](=O)(=O)c2ccc(NC(=O)c3cccc4ccccc34)cc2)nn1
SMILES_CANONICALOpenEye OEToolkits3.1.0.0CCc1nnc(s1)NS(=O)(=O)c2ccc(cc2)NC(=O)c3cccc4c3cccc4
SMILESOpenEye OEToolkits3.1.0.0CCc1nnc(s1)NS(=O)(=O)c2ccc(cc2)NC(=O)c3cccc4c3cccc4

258735

PDB entries from 2026-08-26

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