2-(2,2-diethoxyethylsulfanyl)-1H-benzimidazol-3-ium

Systemtic Name: 2-(2,2-diethoxyethylsulfanyl)-1H-benzimidazol-3-ium Openeye Name: 2-(2,2-diethoxyethylsulfanyl)-1H-benzimidazol-3-ium CAS Name: 2-(2,2-diethoxyethylthio)-1H-benzimidazol-3-ium IUPAC Name: 2-(2,2-diethoxyethylsulfanyl)-1H-benzimidazol-3-ium Traditional Name: 2-(2,2-diethoxyethylthio)-1H-benzimidazol-3-ium Formula: C13H19N2O2S+ MolecularWeight: 267.36716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CSC1=[NH+]C2=CC=CC=C2N1)OCC

Isomeric SMILES

CCOC(CSC1=[NH+]C2=CC=CC=C2N1)OCC

InChI

InChI=1S/C13H18N2O2S/c1-3-16-12(17-4-2)9-18-13-14-10-7-5-6-8-11(10)15-13/h5-8,12H,3-4,9H2,1-2H3,(H,14,15)/p+1