1-methyl-2-[5-(1-methylpyridin-1-ium-2-yl)sulfanylpentylsulfanyl]pyridin-1-ium dibromide

Systemtic Name: 1-methyl-2-[5-(1-methylpyridin-1-ium-2-yl)sulfanylpentylsulfanyl]pyridin-1-ium dibromide Openeye Name: 1-methyl-2-[5-(1-methylpyridin-1-ium-2-yl)sulfanylpentylsulfanyl]pyridin-1-ium dibromide CAS Name: 1-methyl-2-[5-[(1-methyl-2-pyridin-1-iumyl)thio]pentylthio]pyridin-1-ium dibromide IUPAC Name: 1-methyl-2-[5-(1-methylpyridin-1-ium-2-yl)sulfanylpentylsulfanyl]pyridin-1-ium dibromide Traditional Name: 1-methyl-2-[5-[(1-methylpyridin-1-ium-2-yl)thio]pentylthio]pyridin-1-ium dibromide Formula: C17H24Br2N2S2 MolecularWeight: 480.32386

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1SCCCCCSC2=CC=CC=[N+]2C.[Br-].[Br-]

Isomeric SMILES

C[N+]1=CC=CC=C1SCCCCCSC2=CC=CC=[N+]2C.[Br-].[Br-]

InChI

InChI=1S/C17H24N2S2.2BrH/c1-18-12-6-4-10-16(18)20-14-8-3-9-15-21-17-11-5-7-13-19(17)2;;/h4-7,10-13H,3,8-9,14-15H2,1-2H3;2*1H/q+2;;/p-2