ethyl 2-[6-(4-chlorophenyl)-3-cyano-4-methylsulfanyl-2-oxidanylidene-pyridin-1-yl]ethanoate

Systemtic Name: ethyl 2-[6-(4-chlorophenyl)-3-cyano-4-methylsulfanyl-2-oxidanylidene-pyridin-1-yl]ethanoate Openeye Name: ethyl 2-[6-(4-chlorophenyl)-3-cyano-4-methylsulfanyl-2-oxo-1-pyridyl]acetate CAS Name: 2-[6-(4-chlorophenyl)-3-cyano-4-(methylthio)-2-oxo-1-pyridinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-(4-chlorophenyl)-3-cyano-4-methylsulfanyl-2-oxopyridin-1-yl]acetate Traditional Name: 2-[6-(4-chlorophenyl)-3-cyano-2-keto-4-(methylthio)-1-pyridyl]acetic acid ethyl ester Formula: C17H15ClN2O3S MolecularWeight: 362.8306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=CC(=C(C1=O)C#N)SC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)CN1C(=CC(=C(C1=O)C#N)SC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15ClN2O3S/c1-3-23-16(21)10-20-14(11-4-6-12(18)7-5-11)8-15(24-2)13(9-19)17(20)22/h4-8H,3,10H2,1-2H3