3-(1-methylpyridin-1-ium-3-yl)-4-[5-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]pentoxy]-1,2,5-thiadiazole diiodide

Systemtic Name: 3-(1-methylpyridin-1-ium-3-yl)-4-[5-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]pentoxy]-1,2,5-thiadiazole diiodide Openeye Name: 3-(1-methylpyridin-1-ium-3-yl)-4-[5-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]pentoxy]-1,2,5-thiadiazole diiodide CAS Name: 3-(1-methyl-3-pyridin-1-iumyl)-4-[5-[[4-(1-methyl-3-pyridin-1-iumyl)-1,2,5-thiadiazol-3-yl]oxy]pentoxy]-1,2,5-thiadiazole diiodide IUPAC Name: 3-(1-methylpyridin-1-ium-3-yl)-4-[5-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]pentoxy]-1,2,5-thiadiazole diiodide Traditional Name: 3-(1-methylpyridin-1-ium-3-yl)-4-[5-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]pentoxy]-1,2,5-thiadiazole diiodide Formula: C21H24I2N6O2S2 MolecularWeight: 710.3932

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C2=NSN=C2OCCCCCOC3=NSN=C3C4=C[N+](=CC=C4)C.[I-].[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C2=NSN=C2OCCCCCOC3=NSN=C3C4=C[N+](=CC=C4)C.[I-].[I-]

InChI

InChI=1S/C21H24N6O2S2.2HI/c1-26-10-6-8-16(14-26)18-20(24-30-22-18)28-12-4-3-5-13-29-21-19(23-31-25-21)17-9-7-11-27(2)15-17;;/h6-11,14-15H,3-5,12-13H2,1-2H3;2*1H/q+2;;/p-2