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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2CC(=O)NC(=C2C#N)SCC(=O)OCC

InChI

InChI=1S/C18H20N2O3S/c1-3-12-5-7-13(8-6-12)14-9-16(21)20-18(15(14)10-19)24-11-17(22)23-4-2/h5-8,14H,3-4,9,11H2,1-2H3,(H,20,21)/t14-/m1/s1