5-[2-(benzimidazol-1-yl)ethyl]-N-(4-chlorophenyl)-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[2-(benzimidazol-1-yl)ethyl]-N-(4-chlorophenyl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-[2-(benzimidazol-1-yl)ethyl]-N-(4-chlorophenyl)-1H-1,2,4-triazol-3-amine CAS Name: 5-[2-(1-benzimidazolyl)ethyl]-N-(4-chlorophenyl)-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[2-(benzimidazol-1-yl)ethyl]-N-(4-chlorophenyl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-[2-(benzimidazol-1-yl)ethyl]-1H-1,2,4-triazol-3-yl]-(4-chlorophenyl)amine Formula: C17H15ClN6 MolecularWeight: 338.7942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCC3=NC(=NN3)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCC3=NC(=NN3)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C17H15ClN6/c18-12-5-7-13(8-6-12)20-17-21-16(22-23-17)9-10-24-11-19-14-3-1-2-4-15(14)24/h1-8,11H,9-10H2,(H2,20,21,22,23)