3-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-pyridin-4-yl-propanamide

Systemtic Name: 3-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-pyridin-4-yl-propanamide Openeye Name: 3-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-(4-pyridyl)propanamide CAS Name: 3-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-pyridin-4-ylpropanamide IUPAC Name: 3-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-pyridin-4-ylpropanamide Traditional Name: 3-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-(4-pyridyl)propionamide Formula: C17H18N4OS MolecularWeight: 326.41602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCCC(=O)NC2=CC=NC=C2)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCCC(=O)NC2=CC=NC=C2)C

InChI

InChI=1S/C17H18N4OS/c1-11-12(2)15(10-18)17(20-13(11)3)23-9-6-16(22)21-14-4-7-19-8-5-14/h4-5,7-8H,6,9H2,1-3H3,(H,19,21,22)