4-methyl-1-[2-[2-(4-methylpyridin-1-ium-1-yl)ethylsulfanyl]ethyl]pyridin-1-ium dibromide

Systemtic Name: 4-methyl-1-[2-[2-(4-methylpyridin-1-ium-1-yl)ethylsulfanyl]ethyl]pyridin-1-ium dibromide Openeye Name: 4-methyl-1-[2-[2-(4-methylpyridin-1-ium-1-yl)ethylsulfanyl]ethyl]pyridin-1-ium dibromide CAS Name: 4-methyl-1-[2-[2-(4-methyl-1-pyridin-1-iumyl)ethylthio]ethyl]pyridin-1-ium dibromide IUPAC Name: 4-methyl-1-[2-[2-(4-methylpyridin-1-ium-1-yl)ethylsulfanyl]ethyl]pyridin-1-ium dibromide Traditional Name: 4-methyl-1-[2-[2-(4-methylpyridin-1-ium-1-yl)ethylthio]ethyl]pyridin-1-ium dibromide Formula: C16H22Br2N2S MolecularWeight: 434.23228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CCSCC[N+]2=CC=C(C=C2)C.[Br-].[Br-]

Isomeric SMILES

CC1=CC=[N+](C=C1)CCSCC[N+]2=CC=C(C=C2)C.[Br-].[Br-]

InChI

InChI=1S/C16H22N2S.2BrH/c1-15-3-7-17(8-4-15)11-13-19-14-12-18-9-5-16(2)6-10-18;;/h3-10H,11-14H2,1-2H3;2*1H/q+2;;/p-2