2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethylazanium dibromide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethylazanium dibromide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethylammonium dibromide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)ethylammonium dibromide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethylazanium dibromide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)ethylammonium dibromide Formula: C9H13Br2N3S MolecularWeight: 355.09262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]2)SCC[NH3+].[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]2)SCC[NH3+].[Br-].[Br-]

InChI

InChI=1S/C9H11N3S.2BrH/c10-5-6-13-9-11-7-3-1-2-4-8(7)12-9;;/h1-4H,5-6,10H2,(H,11,12);2*1H