N-(4-methylphenyl)-2-(4-methylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-methylphenyl)-2-(4-methylquinolin-2-yl)sulfanyl-butanamide Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-N-(p-tolyl)butanamide CAS Name: N-(4-methylphenyl)-2-[(4-methyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(4-methylphenyl)-2-(4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-(p-tolyl)butyramide Formula: C21H22N2OS MolecularWeight: 350.47718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C21H22N2OS/c1-4-19(21(24)22-16-11-9-14(2)10-12-16)25-20-13-15(3)17-7-5-6-8-18(17)23-20/h5-13,19H,4H2,1-3H3,(H,22,24)