[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-[[4-(4-chlorophenyl)sulfanylphenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-[[4-(4-chlorophenyl)sulfanylphenyl]amino]-4-oxidanylidene-butanoate Openeye Name: [2-(3-methylanilino)-2-oxo-ethyl] 4-[4-(4-chlorophenyl)sulfanylanilino]-4-oxo-butanoate CAS Name: 4-[4-[(4-chlorophenyl)thio]anilino]-4-oxobutanoic acid [2-(3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylanilino)-2-oxoethyl] 4-[4-(4-chlorophenyl)sulfanylanilino]-4-oxobutanoate Traditional Name: 4-[4-[(4-chlorophenyl)thio]anilino]-4-keto-butyric acid [2-keto-2-(m-toluidino)ethyl] ester Formula: C25H23ClN2O4S MolecularWeight: 482.97912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H23ClN2O4S/c1-17-3-2-4-20(15-17)28-24(30)16-32-25(31)14-13-23(29)27-19-7-11-22(12-8-19)33-21-9-5-18(26)6-10-21/h2-12,15H,13-14,16H2,1H3,(H,27,29)(H,28,30)