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

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-ethylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-ethylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-(4-ethyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-ethylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-(4-ethylpiperazin-4-ium-1-yl)ethanone Formula: C15H21N4OS+ MolecularWeight: 305.41844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4OS/c1-2-18-7-9-19(10-8-18)14(20)11-21-15-16-12-5-3-4-6-13(12)17-15/h3-6H,2,7-11H2,1H3,(H,16,17)/p+1