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

Systemtic Name: 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-pyridin-4-yl-butanamide Openeye Name: 2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(4-pyridyl)butanamide CAS Name: 2-[(3-cyano-6-methyl-2-pyridinyl)thio]-N-pyridin-4-ylbutanamide IUPAC Name: 2-(3-cyano-6-methylpyridin-2-yl)sulfanyl-N-pyridin-4-ylbutanamide Traditional Name: 2-[(3-cyano-6-methyl-2-pyridyl)thio]-N-(4-pyridyl)butyramide Formula: C16H16N4OS MolecularWeight: 312.38944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=NC=C1)SC2=C(C=CC(=N2)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=NC=C1)SC2=C(C=CC(=N2)C)C#N

InChI

InChI=1S/C16H16N4OS/c1-3-14(15(21)20-13-6-8-18-9-7-13)22-16-12(10-17)5-4-11(2)19-16/h4-9,14H,3H2,1-2H3,(H,18,20,21)