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CHEBI:73041 - tilmacoxib

ChEBI IDCHEBI:73041
ChEBI Nametilmacoxib
Stars
DefinitionA member of the class of 1,3-oxazoles that is that is 1,3-oxazole which is substituted at positions 2, 4 and 5 by methyl, cyclohexyl, and 3-fluoro-4-sulfamoylphenyl groups, respectively.
Last Modified27 March 2013
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H19FN2O3S
Net Charge0
Average Mass338.404
Monoisotopic Mass338.11004
SMILESCc1nc(C2CCCCC2)c(-c2ccc(S(N)(=O)=O)c(F)c2)o1
InChIInChI=1S/C16H19FN2O3S/c1-10-19-15(11-5-3-2-4-6-11)16(22-10)12-7-8-14(13(17)9-12)23(18,20)21/h7-9,11H,2-6H2,1H3,(H2,18,20,21)
InChIKeyMIMJSJSRRDZIPW-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
cyclooxygenase 2 inhibitor  A cyclooxygenase inhibitor that interferes with the action of cyclooxygenase 2.
ChEBI Ontology
Outgoing Relation(s)
tilmacoxib (CHEBI:73041) has role cyclooxygenase 2 inhibitor (CHEBI:50629)
tilmacoxib (CHEBI:73041) is a 1,3-oxazoles (CHEBI:46812)
tilmacoxib (CHEBI:73041) is a organofluorine compound (CHEBI:37143)
tilmacoxib (CHEBI:73041) is a sulfonamide (CHEBI:35358)
IUPAC Name 
4-(4-cyclohexyl-2-methyl-1,3-oxazol-5-yl)-2-fluorobenzenesulfonamide
INNs  Source
tilmacoxibWHO MedNet
tilmacoxibWHO MedNet
tilmacoxibumWHO MedNet
tilmacoxibWHO MedNet
Synonyms  Source
4-(4-cyclohexyl-2-methyloxazol-5-yl)-2-fluorobenzenesulfonamideChemIDplus
JTE-522ChemIDplus
JTP-19605ChemIDplus
5-ethoxymethyl-7-fluoro-3-oxo-1,2,3,5-tetrahydrobenzo(4,5)imidazo(1,2a)pyridine-4-N-(2-fluorophenyl)carboxamideChemIDplus
RWJ-57504ChemIDplus
Manual XrefsDatabases
TilmacoxibWikipedia
D01974KEGG DRUG
Registry NumbersSources
Reaxys:9005354Reaxys
CAS:180200-68-4KEGG DRUG
CAS:180200-68-4ChemIDplus
Citations