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CHEBI:228734 - 4-{[5-(trifluoromethyl)-2-pyridyl]oxy}benzene-1-carbothioamide

ChEBI IDCHEBI:228734
ChEBI Name4-{[5-(trifluoromethyl)-2-pyridyl]oxy}benzene-1-carbothioamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H9F3N2OS
Net Charge0
Average Mass298.289
Monoisotopic Mass298.03877
SMILESNC(=S)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1
InChIInChI=1S/C13H9F3N2OS/c14-13(15,16)9-3-6-11(18-7-9)19-10-4-1-8(2-5-10)12(17)20/h1-7H,(H2,17,20)
InChIKeyFGJWEIQVLMFFOC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
4-{[5-(trifluoromethyl)-2-pyridyl]oxy}benzene-1-carbothioamide (CHEBI:228734) is a aromatic ether (CHEBI:35618)
IUPAC Name 
4-[5-(triluoromethyl)pyridin-2-yl]oxybenzenecarbothioamide
Manual XrefsDatabases
2058061ChemSpider