2-(2-cyclohexylethylsulfanyl)-1H-benzimidazol-3-ium

Systemtic Name: 2-(2-cyclohexylethylsulfanyl)-1H-benzimidazol-3-ium Openeye Name: 2-(2-cyclohexylethylsulfanyl)-1H-benzimidazol-3-ium CAS Name: 2-(2-cyclohexylethylthio)-1H-benzimidazol-3-ium IUPAC Name: 2-(2-cyclohexylethylsulfanyl)-1H-benzimidazol-3-ium Traditional Name: 2-(2-cyclohexylethylthio)-1H-benzimidazol-3-ium Formula: C15H21N2S+ MolecularWeight: 261.40564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCSC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

C1CCC(CC1)CCSC2=[NH+]C3=CC=CC=C3N2

InChI

InChI=1S/C15H20N2S/c1-2-6-12(7-3-1)10-11-18-15-16-13-8-4-5-9-14(13)17-15/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,16,17)/p+1