(3-cyanophenyl)methyl 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (3-cyanophenyl)methyl 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (3-cyanophenyl)methyl 2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-chloroanilino)-2-oxoethyl]thio]acetic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]acetic acid (3-cyanobenzyl) ester Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC(=O)CSCC(=O)NC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)COC(=O)CSCC(=O)NC2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C18H15ClN2O3S/c19-15-4-6-16(7-5-15)21-17(22)11-25-12-18(23)24-10-14-3-1-2-13(8-14)9-20/h1-8H,10-12H2,(H,21,22)