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

Systemtic Name: 3-[2-(2-methoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole iodide Openeye Name: 3-[2-(2-methoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole iodide CAS Name: 3-[2-(2-methoxyethoxy)ethoxy]-4-(1-methyl-3-pyridin-1-iumyl)-1,2,5-thiadiazole iodide IUPAC Name: 3-[2-(2-methoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole iodide Traditional Name: 3-[2-(2-methoxyethoxy)ethoxy]-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole iodide Formula: C13H18IN3O3S MolecularWeight: 423.26979

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C2=NSN=C2OCCOCCOC.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C2=NSN=C2OCCOCCOC.[I-]

InChI

InChI=1S/C13H18N3O3S.HI/c1-16-5-3-4-11(10-16)12-13(15-20-14-12)19-9-8-18-7-6-17-2;/h3-5,10H,6-9H2,1-2H3;1H/q+1;/p-1