1-(4-methylpiperazin-4-ium-1-yl)-2-[2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]ethanone

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]ethanone Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]ethanone CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-2-[2-[[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]thio]-1-benzimidazolyl]ethanone IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]sulfanylbenzimidazol-1-yl]ethanone Traditional Name: 2-[2-[[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]thio]benzimidazol-1-yl]-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C21H32N6O2S+2 MolecularWeight: 432.58278

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)N4CC[NH+](CC4)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C21H30N6O2S/c1-23-7-11-25(12-8-23)19(28)15-27-18-6-4-3-5-17(18)22-21(27)30-16-20(29)26-13-9-24(2)10-14-26/h3-6H,7-16H2,1-2H3/p+2