6-(4,4-dimethylpiperazin-4-ium-1-yl)carbothioylsulfanylhexyl 4,4-dimethylpiperazin-4-ium-1-carbodithioate dibromide

Systemtic Name: 6-(4,4-dimethylpiperazin-4-ium-1-yl)carbothioylsulfanylhexyl 4,4-dimethylpiperazin-4-ium-1-carbodithioate dibromide Openeye Name: 6-(4,4-dimethylpiperazin-4-ium-1-carbothioyl)sulfanylhexyl 4,4-dimethylpiperazin-4-ium-1-carbodithioate dibromide CAS Name: 4,4-dimethyl-1-piperazin-4-iumcarbodithioic acid 6-[[(4,4-dimethyl-1-piperazin-4-iumyl)-sulfanylidenemethyl]thio]hexyl ester dibromide IUPAC Name: 6-(4,4-dimethylpiperazin-4-ium-1-carbothioyl)sulfanylhexyl 4,4-dimethylpiperazin-4-ium-1-carbodithioate dibromide Traditional Name: 4,4-dimethylpiperazin-4-ium-1-carbodithioic acid 6-[(4,4-dimethylpiperazin-4-ium-1-carbothioyl)thio]hexyl ester dibromide Formula: C20H40Br2N4S4 MolecularWeight: 624.6264

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C(=S)SCCCCCCSC(=S)N2CC[N+](CC2)(C)C)C.[Br-].[Br-]

Isomeric SMILES

C[N+]1(CCN(CC1)C(=S)SCCCCCCSC(=S)N2CC[N+](CC2)(C)C)C.[Br-].[Br-]

InChI

InChI=1S/C20H40N4S4.2BrH/c1-23(2)13-9-21(10-14-23)19(25)27-17-7-5-6-8-18-28-20(26)22-11-15-24(3,4)16-12-22;;/h5-18H2,1-4H3;2*1H/q+2;;/p-2