[1-(1H-benzimidazol-3-ium-2-yl)-3-methylsulfanyl-propyl]azanium dichloride

Systemtic Name: [1-(1H-benzimidazol-3-ium-2-yl)-3-methylsulfanyl-propyl]azanium dichloride Openeye Name: [1-(1H-benzimidazol-3-ium-2-yl)-3-methylsulfanyl-propyl]ammonium dichloride CAS Name: [1-(1H-benzimidazol-3-ium-2-yl)-3-(methylthio)propyl]ammonium dichloride IUPAC Name: [1-(1H-benzimidazol-3-ium-2-yl)-3-methylsulfanylpropyl]azanium dichloride Traditional Name: [1-(1H-benzimidazol-3-ium-2-yl)-3-(methylthio)propyl]ammonium dichloride Formula: C11H17Cl2N3S MolecularWeight: 294.24378

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=[NH+]C2=CC=CC=C2N1)[NH3+].[Cl-].[Cl-]

Isomeric SMILES

CSCCC(C1=[NH+]C2=CC=CC=C2N1)[NH3+].[Cl-].[Cl-]

InChI

InChI=1S/C11H15N3S.2ClH/c1-15-7-6-8(12)11-13-9-4-2-3-5-10(9)14-11;;/h2-5,8H,6-7,12H2,1H3,(H,13,14);2*1H