N-[(4-methylphenyl)methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-(p-tolylmethyl)pyridine-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(4-methylbenzyl)-2-(methylthio)nicotinamide Formula: C15H16N2OS MolecularWeight: 272.36534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C15H16N2OS/c1-11-5-7-12(8-6-11)10-17-14(18)13-4-3-9-16-15(13)19-2/h3-9H,10H2,1-2H3,(H,17,18)