2-(cyanomethylsulfanyl)-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-(cyanomethylsulfanyl)-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-(cyanomethylthio)-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-(cyanomethylthio)-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C13H16N2OS MolecularWeight: 248.34394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSCC#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSCC#N)C

InChI

InChI=1S/C13H16N2OS/c1-3-11-6-4-5-10(2)13(11)15-12(16)9-17-8-7-14/h4-6H,3,8-9H2,1-2H3,(H,15,16)