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

Systemtic Name: 2-[[5-cyano-4-(2-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[[5-cyano-4-(o-tolyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[[5-cyano-4-(2-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]thio]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[[5-cyano-4-(2-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[[5-cyano-2-keto-4-(o-tolyl)-3,4-dihydro-1H-pyridin-6-yl]thio]-N-(3-fluorophenyl)acetamide Formula: C21H18FN3O2S MolecularWeight: 395.449923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC=CC=C1C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C21H18FN3O2S/c1-13-5-2-3-8-16(13)17-10-19(26)25-21(18(17)11-23)28-12-20(27)24-15-7-4-6-14(22)9-15/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26)