2-(3-piperidin-1-ium-1-ylpropylsulfanyl)-1H-benzimidazole

Systemtic Name: 2-(3-piperidin-1-ium-1-ylpropylsulfanyl)-1H-benzimidazole Openeye Name: 2-(3-piperidin-1-ium-1-ylpropylsulfanyl)-1H-benzimidazole CAS Name: 2-[3-(1-piperidin-1-iumyl)propylthio]-1H-benzimidazole IUPAC Name: 2-(3-piperidin-1-ium-1-ylpropylsulfanyl)-1H-benzimidazole Traditional Name: 2-(3-piperidin-1-ium-1-ylpropylthio)-1H-benzimidazole Formula: C15H22N3S+ MolecularWeight: 276.42028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1CC[NH+](CC1)CCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C15H21N3S/c1-4-9-18(10-5-1)11-6-12-19-15-16-13-7-2-3-8-14(13)17-15/h2-3,7-8H,1,4-6,9-12H2,(H,16,17)/p+1