2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-(4-fluorophenyl)butanamide

Systemtic Name: 2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-(4-fluorophenyl)butanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(4-fluorophenyl)butanamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-(4-fluorophenyl)butanamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(4-fluorophenyl)butanamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-(4-fluorophenyl)butyramide Formula: C19H18FN3O2S MolecularWeight: 371.428523

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC(=C(C=C2C#N)C(=O)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC(=C(C=C2C#N)C(=O)C)C

InChI

InChI=1S/C19H18FN3O2S/c1-4-17(18(25)23-15-7-5-14(20)6-8-15)26-19-13(10-21)9-16(12(3)24)11(2)22-19/h5-9,17H,4H2,1-3H3,(H,23,25)