N-[(1S)-1-(2-methylphenyl)ethyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[(1S)-1-(2-methylphenyl)ethyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[(1S)-1-(o-tolyl)ethyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[(1S)-1-(2-methylphenyl)ethyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[(1S)-1-(2-methylphenyl)ethyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[(1S)-1-(o-tolyl)ethyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NC(=O)CSC2=NC=NN2

Isomeric SMILES

CC1=CC=CC=C1[C@H](C)NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C13H16N4OS/c1-9-5-3-4-6-11(9)10(2)16-12(18)7-19-13-14-8-15-17-13/h3-6,8,10H,7H2,1-2H3,(H,16,18)(H,14,15,17)/t10-/m0/s1