[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: [1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 4-(2-cyanoethanoylamino)benzoate Openeye Name: [1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl] 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid [2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl] ester Formula: C19H18N4O6S MolecularWeight: 430.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C19H18N4O6S/c1-12(18(25)23-15-6-8-16(9-7-15)30(21,27)28)29-19(26)13-2-4-14(5-3-13)22-17(24)10-11-20/h2-9,12H,10H2,1H3,(H,22,24)(H,23,25)(H2,21,27,28)