1-(1,3-dimethylimidazol-1-ium-2-yl)sulfanyl-3-(1-methylimidazol-2-yl)sulfanyl-propan-2-one chloride

Systemtic Name: 1-(1,3-dimethylimidazol-1-ium-2-yl)sulfanyl-3-(1-methylimidazol-2-yl)sulfanyl-propan-2-one chloride Openeye Name: 1-(1,3-dimethylimidazol-1-ium-2-yl)sulfanyl-3-(1-methylimidazol-2-yl)sulfanyl-propan-2-one chloride CAS Name: 1-[(1,3-dimethyl-2-imidazol-1-iumyl)thio]-3-[(1-methyl-2-imidazolyl)thio]-2-propanone chloride IUPAC Name: 1-(1,3-dimethylimidazol-1-ium-2-yl)sulfanyl-3-(1-methylimidazol-2-yl)sulfanylpropan-2-one chloride Traditional Name: 1-[(1,3-dimethylimidazol-1-ium-2-yl)thio]-3-[(1-methylimidazol-2-yl)thio]acetone chloride Formula: C12H17ClN4OS2 MolecularWeight: 332.87258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)CSC2=[N+](C=CN2C)C.[Cl-]

Isomeric SMILES

CN1C=CN=C1SCC(=O)CSC2=[N+](C=CN2C)C.[Cl-]

InChI

InChI=1S/C12H17N4OS2.ClH/c1-14-5-4-13-11(14)18-8-10(17)9-19-12-15(2)6-7-16(12)3;/h4-7H,8-9H2,1-3H3;1H/q+1;/p-1