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

Systemtic Name: (phenylmethyl) 2-[(5-cyano-4-naphthalen-1-yl-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]ethanoate Openeye Name: benzyl 2-[[5-cyano-4-(1-naphthyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate CAS Name: 2-[[5-cyano-4-(1-naphthalenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(5-cyano-4-naphthalen-1-yl-2-oxo-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]acetate Traditional Name: 2-[[5-cyano-2-keto-4-(1-naphthyl)-3,4-dihydro-1H-pyridin-6-yl]thio]acetic acid benzyl ester Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=C(NC1=O)SCC(=O)OCC2=CC=CC=C2)C#N)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1C(C(=C(NC1=O)SCC(=O)OCC2=CC=CC=C2)C#N)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H20N2O3S/c26-14-22-21(20-12-6-10-18-9-4-5-11-19(18)20)13-23(28)27-25(22)31-16-24(29)30-15-17-7-2-1-3-8-17/h1-12,21H,13,15-16H2,(H,27,28)