(2S)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylphenyl)propanamide

Systemtic Name: (2S)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylphenyl)propanamide Openeye Name: (2S)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(o-tolyl)propanamide CAS Name: (2S)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(2-methylphenyl)propanamide IUPAC Name: (2S)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylphenyl)propanamide Traditional Name: (2S)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(o-tolyl)propionamide Formula: C19H26N4OS MolecularWeight: 358.50094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2C3CCCCC3)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C)SC2=NN=C(N2C3CCCCC3)C

InChI

InChI=1S/C19H26N4OS/c1-13-9-7-8-12-17(13)20-18(24)14(2)25-19-22-21-15(3)23(19)16-10-5-4-6-11-16/h7-9,12,14,16H,4-6,10-11H2,1-3H3,(H,20,24)/t14-/m0/s1