2-methyl-1-[[4-(4-methylphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzimidazole

Systemtic Name: 2-methyl-1-[[4-(4-methylphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzimidazole Openeye Name: 1-[[5-benzylsulfanyl-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-benzimidazole CAS Name: 2-methyl-1-[[4-(4-methylphenyl)-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]benzimidazole IUPAC Name: 1-[[5-benzylsulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]-2-methylbenzimidazole Traditional Name: 1-[[5-(benzylthio)-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-benzimidazole Formula: C25H23N5S MolecularWeight: 425.54862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)CN4C(=NC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)CN4C(=NC5=CC=CC=C54)C

InChI

InChI=1S/C25H23N5S/c1-18-12-14-21(15-13-18)30-24(16-29-19(2)26-22-10-6-7-11-23(22)29)27-28-25(30)31-17-20-8-4-3-5-9-20/h3-15H,16-17H2,1-2H3