phenacyl 4-[[4-(4-chlorophenyl)sulfanylphenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: phenacyl 4-[[4-(4-chlorophenyl)sulfanylphenyl]amino]-4-oxidanylidene-butanoate Openeye Name: phenacyl 4-[4-(4-chlorophenyl)sulfanylanilino]-4-oxo-butanoate CAS Name: 4-[4-[(4-chlorophenyl)thio]anilino]-4-oxobutanoic acid phenacyl ester IUPAC Name: phenacyl 4-[4-(4-chlorophenyl)sulfanylanilino]-4-oxobutanoate Traditional Name: 4-[4-[(4-chlorophenyl)thio]anilino]-4-keto-butyric acid phenacyl ester Formula: C24H20ClNO4S MolecularWeight: 453.9379

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20ClNO4S/c25-18-6-10-20(11-7-18)31-21-12-8-19(9-13-21)26-23(28)14-15-24(29)30-16-22(27)17-4-2-1-3-5-17/h1-13H,14-16H2,(H,26,28)