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CHEBI:72717 - 1,3-dimethyl-2-[(2-oxopropyl)thio]imidazolium

ChEBI IDCHEBI:72717
ChEBI Name1,3-dimethyl-2-[(2-oxopropyl)thio]imidazolium
Stars
DefinitionAn imidazolium ion obtained by methylation at position 3 of 1-methyl-2-[(2-oxopropyl)thio]imidazole.
Last Modified8 March 2013
SubmitterSteve
DownloadsMolfile
FormulaC8H13N2OS
Net Charge+1
Average Mass185.272
Monoisotopic Mass185.07431
SMILESCC(=O)CSc1n(C)cc[n+]1C
InChIInChI=1S/C8H13N2OS/c1-7(11)6-12-8-9(2)4-5-10(8)3/h4-5H,6H2,1-3H3/q+1
InChIKeyVQLITXBUXQZTRP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1,3-dimethyl-2-[(2-oxopropyl)thio]imidazolium (CHEBI:72717) is a imidazolium ion (CHEBI:59964)
Incoming Relation(s)
1,3-dimethyl-2-[(2-oxopropyl)thio]imidazolium chloride (CHEBI:72702) has part 1,3-dimethyl-2-[(2-oxopropyl)thio]imidazolium (CHEBI:72717)
IUPAC Name 
1,3-dimethyl-2-[(2-oxopropyl)sulfanyl]-1H-imidazol-3-ium
Synonym  Source
1,3-dimethyl-2-[(2-oxopropyl)thio]imidazolium cationChEBI