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CHEBI:177595 - sulnidazole

ChEBI IDCHEBI:177595
ChEBI Namesulnidazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H14N4O3S
Net Charge0
Average Mass258.303
Monoisotopic Mass258.07866
SMILESCCc1ncc([N+](=O)[O-])n1CCNC(=S)OC
InChIInChI=1S/C9H14N4O3S/c1-3-7-11-6-8(13(14)15)12(7)5-4-10-9(17)16-2/h6H,3-5H2,1-2H3,(H,10,17)
InChIKeyBDRFWSJMVOBAHR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
sulnidazole (CHEBI:177595) is a C-nitro compound (CHEBI:35716)
sulnidazole (CHEBI:177595) is a imidazoles (CHEBI:24780)
IUPAC Name 
O-methyl N-[2-(2-ethyl-5-nitroimidazol-1-yl)ethyl]carbamothioate
Manual XrefsDatabases
D05966KEGG DRUG
2300988ChemSpider
Registry NumbersSources
CAS:51022-76-5ChemIDplus