1-(4-methylpiperazin-4-ium-1-yl)-2-[3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanylquinoxalin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanylquinoxalin-2-yl]sulfanyl-ethanone Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]sulfanylquinoxalin-2-yl]sulfanyl-ethanone CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-2-[[3-[[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]thio]-2-quinoxalinyl]thio]ethanone IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]sulfanylquinoxalin-2-yl]sulfanylethanone Traditional Name: 2-[[3-[[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]thio]quinoxalin-2-yl]thio]-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C22H32N6O2S2+2 MolecularWeight: 476.65848

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N=C2SCC(=O)N4CC[NH+](CC4)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N=C2SCC(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C22H30N6O2S2/c1-25-7-11-27(12-8-25)19(29)15-31-21-22(24-18-6-4-3-5-17(18)23-21)32-16-20(30)28-13-9-26(2)10-14-28/h3-6H,7-16H2,1-2H3/p+2