3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(phenylcarbamoyl)propanamide

Systemtic Name: 3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(phenylcarbamoyl)propanamide Openeye Name: 3-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(phenylcarbamoyl)propanamide CAS Name: N-[anilino(oxo)methyl]-3-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]propanamide IUPAC Name: 3-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-(phenylcarbamoyl)propanamide Traditional Name: 3-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-(phenylcarbamoyl)propionamide Formula: C18H18N4O2S MolecularWeight: 354.42612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O2S/c1-12-10-13(2)20-17(15(12)11-19)25-9-8-16(23)22-18(24)21-14-6-4-3-5-7-14/h3-7,10H,8-9H2,1-2H3,(H2,21,22,23,24)