2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(2-methylphenyl)ethyl]ethanamide

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(2-methylphenyl)ethyl]ethanamide Openeye Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(o-tolyl)ethyl]acetamide CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-[1-(2-methylphenyl)ethyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(2-methylphenyl)ethyl]acetamide Traditional Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-[1-(o-tolyl)ethyl]acetamide Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NC(=O)CSC2=NNC(=N2)C3CC3

Isomeric SMILES

CC1=CC=CC=C1C(C)NC(=O)CSC2=NNC(=N2)C3CC3

InChI

InChI=1S/C16H20N4OS/c1-10-5-3-4-6-13(10)11(2)17-14(21)9-22-16-18-15(19-20-16)12-7-8-12/h3-6,11-12H,7-9H2,1-2H3,(H,17,21)(H,18,19,20)