[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Openeye Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 4,5-dihydrobenzo[g]benzothiophene-2-carboxylate CAS Name: 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Traditional Name: 4,5-dihydrobenzo[g]benzothiophene-2-carboxylic acid [2-keto-2-(4-sulfamoylanilino)ethyl] ester Formula: C21H18N2O5S2 MolecularWeight: 442.50802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)OCC(=O)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)OCC(=O)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H18N2O5S2/c22-30(26,27)16-9-7-15(8-10-16)23-19(24)12-28-21(25)18-11-14-6-5-13-3-1-2-4-17(13)20(14)29-18/h1-4,7-11H,5-6,12H2,(H,23,24)(H2,22,26,27)