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

Systemtic Name: N-(3,4-dimethylphenyl)-2-[[4-(4-methylphenyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(3,4-dimethylphenyl)-2-[[5-phenethyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3,4-dimethylphenyl)-2-[[4-(4-methylphenyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[[4-(4-methylphenyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(3,4-dimethylphenyl)-2-[[5-phenethyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=C(C=C3)C)C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=C(C=C3)C)C)CCC4=CC=CC=C4

InChI

InChI=1S/C27H28N4OS/c1-19-9-14-24(15-10-19)31-25(16-12-22-7-5-4-6-8-22)29-30-27(31)33-18-26(32)28-23-13-11-20(2)21(3)17-23/h4-11,13-15,17H,12,16,18H2,1-3H3,(H,28,32)