[2-[(2-butan-2-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [2-[(2-butan-2-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Openeye Name: [2-oxo-2-(2-sec-butylanilino)ethyl] 3-[methyl(p-tolyl)sulfamoyl]benzoate CAS Name: 3-[methyl-(4-methylphenyl)sulfamoyl]benzoic acid [2-(2-butan-2-ylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-butan-2-ylanilino)-2-oxoethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Traditional Name: 3-[methyl(p-tolyl)sulfamoyl]benzoic acid [2-keto-2-(2-sec-butylanilino)ethyl] ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H30N2O5S/c1-5-20(3)24-11-6-7-12-25(24)28-26(30)18-34-27(31)21-9-8-10-23(17-21)35(32,33)29(4)22-15-13-19(2)14-16-22/h6-17,20H,5,18H2,1-4H3,(H,28,30)