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

Systemtic Name: 2-[[5-cyano-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[5-cyano-2-oxo-4-(p-tolyl)-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide CAS Name: 2-[[5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide Traditional Name: N-benzyl-2-[[5-cyano-2-keto-4-(p-tolyl)-3,4-dihydro-1H-pyridin-6-yl]thio]acetamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O2S/c1-15-7-9-17(10-8-15)18-11-20(26)25-22(19(18)12-23)28-14-21(27)24-13-16-5-3-2-4-6-16/h2-10,18H,11,13-14H2,1H3,(H,24,27)(H,25,26)