ethyl 4-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]-3-oxo-butanoate CAS Name: 4-[[6-(4-chlorophenyl)-3-cyano-2-pyridinyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl-3-oxobutanoate Traditional Name: 4-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]thio]-3-keto-butyric acid ethyl ester Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=C(C=CC(=N1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=C(C=CC(=N1)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C18H15ClN2O3S/c1-2-24-17(23)9-15(22)11-25-18-13(10-20)5-8-16(21-18)12-3-6-14(19)7-4-12/h3-8H,2,9,11H2,1H3