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CHEBI:90929 - lesinurad

Default Structure
ChEBI IDCHEBI:90929
ChEBI Namelesinurad
Stars
DefinitionA member of the class of triazoles that is [(3-bromo-1,2,4-triazol-5-yl)sulfanyl]acetic acid substituted at position 1 of the triazole ring by a 4-cyclopropylnaphthalen-1-yl group. Used for treatment of gout.
Last Modified22 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC17H14BrN3O2S
Net Charge0
Average Mass404.289
Monoisotopic Mass402.99901
SMILESO=C(O)CSc1nnc(Br)n1-c1ccc(C2CC2)c2ccccc12
InChIInChI=1S/C17H14BrN3O2S/c18-16-19-20-17(24-9-15(22)23)21(16)14-8-7-11(10-5-6-10)12-3-1-2-4-13(12)14/h1-4,7-8,10H,5-6,9H2,(H,22,23)
InChIKeyFGQFOYHRJSUHMR-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Applications:
uricosuric drug  A gout suppressant that acts directly on the renal tubule to increase the excretion of uric acid, thus reducing its concentrations in plasma.
gout suppressant  A drug that increases uric acid excretion by the kidney (uricosuric drug), decreases uric acid production (antihyperuricemic), or alleviates the pain and inflammation of acute attacks of gout.
ChEBI Ontology
Outgoing Relation(s)
lesinurad (CHEBI:90929) has role gout suppressant (CHEBI:35845)
lesinurad (CHEBI:90929) has role uricosuric drug (CHEBI:35841)
lesinurad (CHEBI:90929) is a aryl sulfide (CHEBI:35683)
lesinurad (CHEBI:90929) is a cyclopropanes (CHEBI:51454)
lesinurad (CHEBI:90929) is a monocarboxylic acid (CHEBI:25384)
lesinurad (CHEBI:90929) is a naphthalenes (CHEBI:25477)
lesinurad (CHEBI:90929) is a organobromine compound (CHEBI:37141)
lesinurad (CHEBI:90929) is a triazoles (CHEBI:35727)
IUPAC Name 
{[5-bromo-4-(4-cyclopropylnaphthalen-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
INN  Source
lesinuradChemIDplus
Synonyms  Source
RDEA 594ChemIDplus
RDEA-594ChEMBL
RDEA594ChemIDplus
Brand Names  Source
Lesinurad component of duzalloChEMBL
ZurampicChemIDplus
Manual XrefsDatabases
5075DrugCentral
D09921KEGG DRUG
LesinuradWikipedia
Registry NumbersSources
Reaxys:12932464Reaxys
CAS:878672-00-5ChemIDplus
CAS:878672-00-5KEGG DRUG
Citations