[4-[2-cyano-3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]prop-1-enyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[2-cyano-3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]prop-1-enyl]phenyl] 4-methylbenzoate Openeye Name: [4-[2-cyano-3-oxo-3-(4-sulfamoylanilino)prop-1-enyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[2-cyano-3-oxo-3-(4-sulfamoylanilino)prop-1-enyl]phenyl] ester IUPAC Name: [4-[2-cyano-3-oxo-3-(4-sulfamoylanilino)prop-1-enyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[2-cyano-3-keto-3-(4-sulfamoylanilino)prop-1-enyl]phenyl] ester Formula: C24H19N3O5S MolecularWeight: 461.48976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C24H19N3O5S/c1-16-2-6-18(7-3-16)24(29)32-21-10-4-17(5-11-21)14-19(15-25)23(28)27-20-8-12-22(13-9-20)33(26,30)31/h2-14H,1H3,(H,27,28)(H2,26,30,31)