N-(4-methylphenyl)-3-sulfanyl-pyridine-2-carboxamide

Systemtic Name: N-(4-methylphenyl)-3-sulfanyl-pyridine-2-carboxamide Openeye Name: N-(p-tolyl)-3-sulfanyl-pyridine-2-carboxamide CAS Name: 3-mercapto-N-(4-methylphenyl)-2-pyridinecarboxamide IUPAC Name: N-(4-methylphenyl)-3-sulfanylpyridine-2-carboxamide Traditional Name: 3-mercapto-N-(p-tolyl)picolinamide Formula: C13H12N2OS MolecularWeight: 244.31218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(C=CC=N2)S

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(C=CC=N2)S

InChI

InChI=1S/C13H12N2OS/c1-9-4-6-10(7-5-9)15-13(16)12-11(17)3-2-8-14-12/h2-8,17H,1H3,(H,15,16)