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CHEBI:177789 - Carnidazole

ChEBI IDCHEBI:177789
ChEBI NameCarnidazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H12N4O3S
Net Charge0
Average Mass244.276
Monoisotopic Mass244.06301
SMILESCOC(=S)NCCn1c([N+](=O)[O-])cnc1C
InChIInChI=1S/C8H12N4O3S/c1-6-10-5-7(12(13)14)11(6)4-3-9-8(16)15-2/h5H,3-4H2,1-2H3,(H,9,16)
InChIKeyOVEVHVURWWTPFC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Carnidazole (CHEBI:177789) is a C-nitro compound (CHEBI:35716)
Carnidazole (CHEBI:177789) is a imidazoles (CHEBI:24780)
IUPAC Name 
O-methyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamothioate
Manual XrefsDatabases
2297829ChemSpider
D03408KEGG DRUG
Registry NumbersSources
CAS:42116-76-7ChemIDplus