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

Systemtic Name: propyl 2-[[(4S)-5-cyano-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]ethanoate Openeye Name: propyl 2-[[(4S)-5-cyano-2-oxo-4-(p-tolyl)-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate CAS Name: 2-[[(4S)-5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]thio]acetic acid propyl ester IUPAC Name: propyl 2-[[(4S)-5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate Traditional Name: 2-[[(4S)-5-cyano-2-keto-4-(p-tolyl)-3,4-dihydro-1H-pyridin-6-yl]thio]acetic acid propyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCOC(=O)CSC1=C([C@@H](CC(=O)N1)C2=CC=C(C=C2)C)C#N

InChI

InChI=1S/C18H20N2O3S/c1-3-8-23-17(22)11-24-18-15(10-19)14(9-16(21)20-18)13-6-4-12(2)5-7-13/h4-7,14H,3,8-9,11H2,1-2H3,(H,20,21)/t14-/m0/s1