2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C14H19N4OS+ MolecularWeight: 291.39186

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C14H18N4OS/c1-17-6-8-18(9-7-17)13(19)10-20-14-15-11-4-2-3-5-12(11)16-14/h2-5H,6-10H2,1H3,(H,15,16)/p+1