2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylbutan-2-yl)ethanamide

Systemtic Name: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylbutan-2-yl)ethanamide Openeye Name: N-(1-methyl-3-phenyl-propyl)-2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(4-phenylbutan-2-yl)acetamide IUPAC Name: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylbutan-2-yl)acetamide Traditional Name: N-(1-methyl-3-phenyl-propyl)-2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC(C)CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC(C)CCC3=CC=CC=C3)C

InChI

InChI=1S/C22H26N4OS/c1-16-9-13-20(14-10-16)26-18(3)24-25-22(26)28-15-21(27)23-17(2)11-12-19-7-5-4-6-8-19/h4-10,13-14,17H,11-12,15H2,1-3H3,(H,23,27)