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

Systemtic Name: propan-2-yl 2-[[5-cyano-4-(4-ethylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[[5-cyano-4-(4-ethylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate CAS Name: 2-[[5-cyano-4-(4-ethylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[5-cyano-4-(4-ethylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate Traditional Name: 2-[[5-cyano-4-(4-ethylphenyl)-2-keto-3,4-dihydro-1H-pyridin-6-yl]thio]acetic acid isopropyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O3S/c1-4-13-5-7-14(8-6-13)15-9-17(22)21-19(16(15)10-20)25-11-18(23)24-12(2)3/h5-8,12,15H,4,9,11H2,1-3H3,(H,21,22)