3-[2-(2-butoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-2-yl)-1,2,5-thiadiazole iodide

Systemtic Name: 3-[2-(2-butoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-2-yl)-1,2,5-thiadiazole iodide Openeye Name: 3-[2-(2-butoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-2-yl)-1,2,5-thiadiazole iodide CAS Name: 3-[2-(2-butoxyethoxy)ethoxy]-4-(1-methyl-2-pyridin-1-iumyl)-1,2,5-thiadiazole iodide IUPAC Name: 3-[2-(2-butoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-2-yl)-1,2,5-thiadiazole iodide Traditional Name: 3-[2-(2-butoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-2-yl)-1,2,5-thiadiazole iodide Formula: C16H24IN3O3S MolecularWeight: 465.34953

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOCCOC1=NSN=C1C2=CC=CC=[N+]2C.[I-]

Isomeric SMILES

CCCCOCCOCCOC1=NSN=C1C2=CC=CC=[N+]2C.[I-]

InChI

InChI=1S/C16H24N3O3S.HI/c1-3-4-9-20-10-11-21-12-13-22-16-15(17-23-18-16)14-7-5-6-8-19(14)2;/h5-8H,3-4,9-13H2,1-2H3;1H/q+1;/p-1