2-azanyl-1-[[3-chloranyl-4-[dimethyl(sulfinato)azaniumyl]phenyl]methyl]benzimidazole hydroiodide

Systemtic Name: 2-azanyl-1-[[3-chloranyl-4-[dimethyl(sulfinato)azaniumyl]phenyl]methyl]benzimidazole hydroiodide Openeye Name: 2-amino-1-[[3-chloro-4-[dimethyl(sulfinato)ammonio]phenyl]methyl]benzimidazole hydroiodide CAS Name: 2-amino-1-[[3-chloro-4-[dimethyl(sulfinato)ammonio]phenyl]methyl]benzimidazole hydroiodide IUPAC Name: 2-amino-1-[[3-chloro-4-[dimethyl(sulfinato)azaniumyl]phenyl]methyl]benzimidazole hydroiodide Traditional Name: 2-amino-1-[3-chloro-4-[dimethyl(sulfinato)ammonio]benzyl]benzimidazole hydroiodide Formula: C16H18ClIN4O2S MolecularWeight: 492.76219

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=C(C=C(C=C1)CN2C3=CC=CC=C3N=C2N)Cl)S(=O)[O-].I

Isomeric SMILES

C[N+](C)(C1=C(C=C(C=C1)CN2C3=CC=CC=C3N=C2N)Cl)S(=O)[O-].I

InChI

InChI=1S/C16H17ClN4O2S.HI/c1-21(2,24(22)23)15-8-7-11(9-12(15)17)10-20-14-6-4-3-5-13(14)19-16(20)18;/h3-9H,10H2,1-2H3,(H2-,18,19,22,23);1H