3-(3-ethoxypropoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole

Systemtic Name: 3-(3-ethoxypropoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole Openeye Name: 3-(3-ethoxypropoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole CAS Name: 3-(3-ethoxypropoxy)-4-(1-methyl-3-pyridin-1-iumyl)-1,2,5-thiadiazole IUPAC Name: 3-(3-ethoxypropoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole Traditional Name: 3-(3-ethoxypropoxy)-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole Formula: C13H18N3O2S+ MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCOC1=NSN=C1C2=C[N+](=CC=C2)C

Isomeric SMILES

CCOCCCOC1=NSN=C1C2=C[N+](=CC=C2)C

InChI

InChI=1S/C13H18N3O2S/c1-3-17-8-5-9-18-13-12(14-19-15-13)11-6-4-7-16(2)10-11/h4,6-7,10H,3,5,8-9H2,1-2H3/q+1