5-(benzimidazol-1-ylmethyl)-4-(2-chlorophenyl)-2-[[methyl-(phenylmethyl)amino]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-(benzimidazol-1-ylmethyl)-4-(2-chlorophenyl)-2-[[methyl-(phenylmethyl)amino]methyl]-1,2,4-triazole-3-thione Openeye Name: 5-(benzimidazol-1-ylmethyl)-2-[[benzyl(methyl)amino]methyl]-4-(2-chlorophenyl)-1,2,4-triazole-3-thione CAS Name: 5-(1-benzimidazolylmethyl)-4-(2-chlorophenyl)-2-[[methyl-(phenylmethyl)amino]methyl]-1,2,4-triazole-3-thione IUPAC Name: 5-(benzimidazol-1-ylmethyl)-2-[[benzyl(methyl)amino]methyl]-4-(2-chlorophenyl)-1,2,4-triazole-3-thione Traditional Name: 5-(benzimidazol-1-ylmethyl)-2-[[benzyl(methyl)amino]methyl]-4-(2-chlorophenyl)-1,2,4-triazole-3-thione Formula: C25H23ClN6S MolecularWeight: 475.00832

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)CN3C=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)CN3C=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C25H23ClN6S/c1-29(15-19-9-3-2-4-10-19)18-31-25(33)32(22-13-7-5-11-20(22)26)24(28-31)16-30-17-27-21-12-6-8-14-23(21)30/h2-14,17H,15-16,18H2,1H3