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CHEBI:228750 - N1-(4-bromo-1H-pyrazol-5-yl)-2,2-dichloroacetamide

Default Structure
ChEBI IDCHEBI:228750
ChEBI NameN1-(4-bromo-1H-pyrazol-5-yl)-2,2-dichloroacetamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC5H4BrCl2N3O
Net Charge0
Average Mass272.917
Monoisotopic Mass270.89148
SMILESO=C(Nc1nncc1Br)C(Cl)Cl
InChIInChI=1S/C5H4BrCl2N3O/c6-2-1-9-11-4(2)10-5(12)3(7)8/h1,3H,(H2,9,10,11,12)
InChIKeyLADRFWUCCBNWBG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
N1-(4-bromo-1H-pyrazol-5-yl)-2,2-dichloroacetamide (CHEBI:228750) is a organobromine compound (CHEBI:37141)
IUPAC Name 
N-(4-bromo-1H-pyrazol-5-yl)-2,2-dichloroacetamide
Manual XrefsDatabases
2086150ChemSpider