ethyl 2-[(5-cyano-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(5-cyano-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(5-cyano-2-oxo-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]acetate CAS Name: 2-[(5-cyano-2-oxo-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5-cyano-2-oxo-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]acetate Traditional Name: 2-[(5-cyano-2-keto-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)thio]acetic acid ethyl ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O3S/c1-2-21-15(20)10-22-16-13(9-17)12(8-14(19)18-16)11-6-4-3-5-7-11/h3-7,12H,2,8,10H2,1H3,(H,18,19)