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

Systemtic Name: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)ethanamide Openeye Name: 2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)acetamide CAS Name: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)acetamide IUPAC Name: 2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)acetamide Traditional Name: 2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)acetamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4OS/c1-15-9-11-19(12-10-15)25-17(3)23-24-21(25)27-14-20(26)22-13-16(2)18-7-5-4-6-8-18/h4-12,16H,13-14H2,1-3H3,(H,22,26)