[2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl] 4-(phenylsulfamoyl)benzoate

Systemtic Name: [2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl] 4-(phenylsulfamoyl)benzoate Openeye Name: [2-[N-(2-cyanoethyl)anilino]-2-oxo-ethyl] 4-(phenylsulfamoyl)benzoate CAS Name: 4-(phenylsulfamoyl)benzoic acid [2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] 4-(phenylsulfamoyl)benzoate Traditional Name: 4-(phenylsulfamoyl)benzoic acid [2-[N-(2-cyanoethyl)anilino]-2-keto-ethyl] ester Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C24H21N3O5S/c25-16-7-17-27(21-10-5-2-6-11-21)23(28)18-32-24(29)19-12-14-22(15-13-19)33(30,31)26-20-8-3-1-4-9-20/h1-6,8-15,26H,7,17-18H2