[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)sulfanylethanoate

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)sulfanylethanoate Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] 2-(4-chlorophenyl)sulfanylacetate CAS Name: 2-[(4-chlorophenyl)thio]acetic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 2-(4-chlorophenyl)sulfanylacetate Traditional Name: 2-[(4-chlorophenyl)thio]acetic acid [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester Formula: C17H12Cl2N2O3S MolecularWeight: 395.25978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1SCC(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl)Cl

InChI

InChI=1S/C17H12Cl2N2O3S/c18-12-2-5-14(6-3-12)25-10-17(23)24-9-16(22)21-13-4-1-11(8-20)15(19)7-13/h1-7H,9-10H2,(H,21,22)