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CHEBI:228683 - 2-(methylthio)-5-[(5-nitro-1,3-thiazol-2-yl)thio]-1,3,4-thiadiazole

ChEBI IDCHEBI:228683
ChEBI Name2-(methylthio)-5-[(5-nitro-1,3-thiazol-2-yl)thio]-1,3,4-thiadiazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H4N4O2S4
Net Charge0
Average Mass292.392
Monoisotopic Mass291.92171
SMILESCSc1nnc(Sc2ncc([N+](=O)[O-])s2)s1
InChIInChI=1S/C6H4N4O2S4/c1-13-5-8-9-6(16-5)15-4-7-2-3(14-4)10(11)12/h2H,1H3
InChIKeyNNMAOGUXRCJFIY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
2-(methylthio)-5-[(5-nitro-1,3-thiazol-2-yl)thio]-1,3,4-thiadiazole (CHEBI:228683) is a aryl sulfide (CHEBI:35683)
IUPAC Name 
2-methylsulanyl-5-[(5-nitro-1,3-thiazol-2-yl)sulanyl]-1,3,4-thiadiazole
Manual XrefsDatabases
2028233ChemSpider