[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 2-[(4-cyanophenyl)methylsulfanyl]benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 2-[(4-cyanophenyl)methylsulfanyl]benzoate Openeye Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-[(4-cyanophenyl)methylsulfanyl]benzoate CAS Name: 2-[(4-cyanophenyl)methylthio]benzoic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-[(4-cyanophenyl)methylsulfanyl]benzoate Traditional Name: 2-[(4-cyanobenzyl)thio]benzoic acid [2-keto-2-(4-sulfamoylanilino)ethyl] ester Formula: C23H19N3O5S2 MolecularWeight: 481.54406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)SCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H19N3O5S2/c24-13-16-5-7-17(8-6-16)15-32-21-4-2-1-3-20(21)23(28)31-14-22(27)26-18-9-11-19(12-10-18)33(25,29)30/h1-12H,14-15H2,(H,26,27)(H2,25,29,30)