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CHEBI:182534 - 1,2,4-Triazin-5(2H)-one, 6-(1,1-dimethylethyl)-3-(methylthio)-

ChEBI IDCHEBI:182534
ChEBI Name1,2,4-Triazin-5(2H)-one, 6-(1,1-dimethylethyl)-3-(methylthio)-
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H13N3OS
Net Charge0
Average Mass199.279
Monoisotopic Mass199.07793
SMILESCSc1nnc(C(C)(C)C)c(=O)n1
InChIInChI=1S/C8H13N3OS/c1-8(2,3)5-6(12)9-7(13-4)11-10-5/h1-4H3,(H,9,11,12)
InChIKeyMIWRSUQXSCLDNV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1,2,4-Triazin-5(2H)-one, 6-(1,1-dimethylethyl)-3-(methylthio)- (CHEBI:182534) is a aryl sulfide (CHEBI:35683)
IUPAC Name 
6-tert-butyl-3-methylsulanyl-4H-1,2,4-triazin-5-one
Manual XrefsDatabases
33978ChemSpider
Registry NumbersSources
CAS:35045-02-4ChemIDplus