[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-[methyl(phenyl)sulfamoyl]benzoate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-[methyl(phenyl)sulfamoyl]benzoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 2-[methyl(phenyl)sulfamoyl]benzoate CAS Name: 2-[methyl(phenyl)sulfamoyl]benzoic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-[methyl(phenyl)sulfamoyl]benzoate Traditional Name: 2-[methyl(phenyl)sulfamoyl]benzoic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C21H17N3O5S2 MolecularWeight: 455.50678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2C(=O)OCC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2C(=O)OCC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C21H17N3O5S2/c1-24(16-7-3-2-4-8-16)31(27,28)18-10-6-5-9-17(18)21(26)29-14-19(25)23-20-15(13-22)11-12-30-20/h2-12H,14H2,1H3,(H,23,25)