[1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(3-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: [2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] 3-(m-tolylsulfamoyl)benzoate CAS Name: 3-[(3-methylphenyl)sulfamoyl]benzoic acid [1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-cyanoanilino)-1-oxopropan-2-yl] 3-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 3-(m-tolylsulfamoyl)benzoic acid [2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C24H21N3O5S/c1-16-7-5-10-20(13-16)27-33(30,31)21-11-6-9-18(14-21)24(29)32-17(2)23(28)26-22-12-4-3-8-19(22)15-25/h3-14,17,27H,1-2H3,(H,26,28)