1-decyl-4-[2-[(1-decylpyridin-1-ium-4-yl)methylsulfanyl]ethylsulfanylmethyl]pyridin-1-ium dibromide

Systemtic Name: 1-decyl-4-[2-[(1-decylpyridin-1-ium-4-yl)methylsulfanyl]ethylsulfanylmethyl]pyridin-1-ium dibromide Openeye Name: 1-decyl-4-[2-[(1-decylpyridin-1-ium-4-yl)methylsulfanyl]ethylsulfanylmethyl]pyridin-1-ium dibromide CAS Name: 1-decyl-4-[[2-[(1-decyl-4-pyridin-1-iumyl)methylthio]ethylthio]methyl]pyridin-1-ium dibromide IUPAC Name: 1-decyl-4-[2-[(1-decylpyridin-1-ium-4-yl)methylsulfanyl]ethylsulfanylmethyl]pyridin-1-ium dibromide Traditional Name: 1-decyl-4-[[2-[(1-decylpyridin-1-ium-4-yl)methylthio]ethylthio]methyl]pyridin-1-ium dibromide Formula: C34H58Br2N2S2 MolecularWeight: 718.77572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1=CC=C(C=C1)CSCCSCC2=CC=[N+](C=C2)CCCCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCC[N+]1=CC=C(C=C1)CSCCSCC2=CC=[N+](C=C2)CCCCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C34H58N2S2.2BrH/c1-3-5-7-9-11-13-15-17-23-35-25-19-33(20-26-35)31-37-29-30-38-32-34-21-27-36(28-22-34)24-18-16-14-12-10-8-6-4-2;;/h19-22,25-28H,3-18,23-24,29-32H2,1-2H3;2*1H/q+2;;/p-2