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

Systemtic Name: propyl 2-[(5-cyano-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]ethanoate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3S/c1-2-8-22-16(21)11-23-17-14(10-18)13(9-15(20)19-17)12-6-4-3-5-7-12/h3-7,13H,2,8-9,11H2,1H3,(H,19,20)