methyl 4-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate

Systemtic Name: methyl 4-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate Openeye Name: methyl 4-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate CAS Name: 4-[[[[4-[(4-ethoxyphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate Traditional Name: 4-[[4-(p-phenetylsulfamoyl)phenyl]thiocarbamoylcarbamoyl]benzoic acid methyl ester Formula: C24H23N3O6S2 MolecularWeight: 513.58592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C24H23N3O6S2/c1-3-33-20-12-8-19(9-13-20)27-35(30,31)21-14-10-18(11-15-21)25-24(34)26-22(28)16-4-6-17(7-5-16)23(29)32-2/h4-15,27H,3H2,1-2H3,(H2,25,26,28,34)