3-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(1H-benzimidazol-2-yl)ethyl]-4-(p-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-(1H-benzimidazol-2-yl)ethyl]-4-(p-tolyl)-1H-1,2,4-triazole-5-thione Formula: C18H17N5S MolecularWeight: 335.42608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NNC2=S)CCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NNC2=S)CCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H17N5S/c1-12-6-8-13(9-7-12)23-17(21-22-18(23)24)11-10-16-19-14-4-2-3-5-15(14)20-16/h2-9H,10-11H2,1H3,(H,19,20)(H,22,24)