Etoricoxib

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Systematic / IUPAC Name: 5-Chloro-2-(6-methylpyridin-3-yl)-3-(4-methylsulfonylphenyl)pyridine

ID: Reference2097

Other Names: Arcoxia;
Tauxib;
Nucoxia;
Algix;
Coxyveen ; more

Formula: C18H15ClN2O2S

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

Etoricoxib mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/26/2015 4:35:10 PM
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Identificators

InChI InChI=1S/C18H15ClN2O2S/c1-12-3-4-14(10-20-12)18-17(9-15(19)11-21-18)13-5-7-16(8-6-13)24(2,22)23/h3-11H,1-2H3
InChI Key MNJVRJDLRVPLFE-UHFFFAOYSA-N
Canonical SMILES CC1=NC=C(C=C1)C2=NC=C(C=C2C3=CC=C(C=C3)S(=O)(=O)C)Cl
CAS 202409334
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Other Names Arcoxia;
Tauxib;
Nucoxia;
Algix;
Coxyveen;
Etorix;
5-Chloro-3-(4-methanesulfonylphenyl)-2-(6-methylpyridin-3-yl)pyridine

In Other Databases

KEGG C11718; D03710
HMDb HMDB15565
ChemSpider 110209
ChemIDPlus 202409334
PubChem 123619
Wikipedia Etoricoxib
DrugBank DB01628
ChEBI CHEBI:6339
ChEMBL CHEMBL416146