[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methoxyphenyl)sulfamoyl]benzoate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methoxyphenyl)sulfamoyl]benzoate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] 3-[(2-methoxyphenyl)sulfamoyl]benzoate CAS Name: 3-[(2-methoxyphenyl)sulfamoyl]benzoic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] 3-[(2-methoxyphenyl)sulfamoyl]benzoate Traditional Name: 3-[(2-methoxyphenyl)sulfamoyl]benzoic acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C23H22N2O6S2 MolecularWeight: 486.56058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C23H22N2O6S2/c1-30-21-12-4-3-11-20(21)25-33(28,29)19-10-5-7-16(13-19)23(27)31-15-22(26)24-17-8-6-9-18(14-17)32-2/h3-14,25H,15H2,1-2H3,(H,24,26)