Benzimidazole, 2-(((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride

2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazol-3-ium chloride

CAS: 87236-36-0

Molecular Formula	`C22H18ClN5S`
Molecular Weight	419.9 g/mol
Topological Polar Surface Area	85.9 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	419.09714
Heavy Atoms	29
Complexity	479.0

Chemical Identifiers

CAS Number	87236-36-0
SMILES	`C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=[NH+]C5=CC=CC=C5N4.[Cl-]`
InChIKey	`RGSBOTFFJGYTIM-UHFFFAOYSA-N`

📖 Product Overview

Benzimidazole, 2-(((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride (CAS: 87236-36-0) is a chemical compound with molecular formula C22H18ClN5S and molecular weight 419.9 g/mol. Its IUPAC systematic name is 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazol-3-ium chloride. Topological Polar Surface Area 85.9 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 419.09714 Heavy Atoms 29 Complexity 479.0 InChI Key: RGSBOTFFJGYTIM-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=[NH+]C5=CC=CC=C5N4.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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