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CHEBI:6339 - etoricoxib
| Formula | C18H15ClN2O2S |
| Net Charge | 0 |
| Average Mass | 358.850 |
| Monoisotopic Mass | 358.05428 |
| SMILES | Cc1ccc(-c2ncc(Cl)cc2-c2ccc(S(C)(=O)=O)cc2)cn1 |
| 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 |
| InChIKey | MNJVRJDLRVPLFE-UHFFFAOYSA-N |
| Wikipedia |
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| Roles Classification |
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| Biological Roles: | antitubercular agent A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis. analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. anti-HIV agent An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus. cyclooxygenase 2 inhibitor A cyclooxygenase inhibitor that interferes with the action of cyclooxygenase 2. |
| Applications: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. antitubercular agent A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis. vulnerary A drug used in treating and healing of wounds. non-steroidal anti-inflammatory drug An anti-inflammatory drug that is not a steroid. In addition to anti-inflammatory actions, non-steroidal anti-inflammatory drugs have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. anti-inflammatory agent Any compound that has anti-inflammatory effects. analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. antirheumatic drug A drug used to treat rheumatoid arthritis. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| etoricoxib (CHEBI:6339) has role analgesic (CHEBI:35480) |
| etoricoxib (CHEBI:6339) has role anti-HIV agent (CHEBI:64946) |
| etoricoxib (CHEBI:6339) has role anti-inflammatory agent (CHEBI:67079) |
| etoricoxib (CHEBI:6339) has role antineoplastic agent (CHEBI:35610) |
| etoricoxib (CHEBI:6339) has role antirheumatic drug (CHEBI:35842) |
| etoricoxib (CHEBI:6339) has role antitubercular agent (CHEBI:33231) |
| etoricoxib (CHEBI:6339) has role cyclooxygenase 2 inhibitor (CHEBI:50629) |
| etoricoxib (CHEBI:6339) has role non-steroidal anti-inflammatory drug (CHEBI:35475) |
| etoricoxib (CHEBI:6339) has role vulnerary (CHEBI:73336) |
| etoricoxib (CHEBI:6339) is a bipyridines (CHEBI:50511) |
| etoricoxib (CHEBI:6339) is a organochlorine compound (CHEBI:36683) |
| etoricoxib (CHEBI:6339) is a sulfone (CHEBI:35850) |
| IUPAC Name |
|---|
| 5-chloro-6'-methyl-3-[4-(methylsulfonyl)phenyl]-2,3'-bipyridine |
| INNs | Source |
|---|---|
| etoricoxib | WHO MedNet |
| etoricoxib | ChemIDplus |
| étoricoxib | WHO MedNet |
| etoricoxibum | WHO MedNet |
| Synonyms | Source |
|---|---|
| 5-chloro-2-(6-methylpyridin-3-yl)-3-(4-(methylsulfonyl)phenyl)pyridine | ChEMBL |
| 5-Chloro-3-(4-methanesulfonyl-phenyl)-6'-methyl-[2,3']bipyridinyl | ChEMBL |
| 5-chloro-6'-methyl-3-(p-(methylsulfonyl)phenyl)-2,3'-bipyridine | ChemIDplus |
| Etoricoxib | KEGG COMPOUND |
| ETORICOXIB | ChEMBL |
| L-791456 | ChEMBL |
| Registry Numbers | Sources |
|---|---|
| CAS:202409-33-4 | KEGG COMPOUND |
| CAS:202409-33-4 | ChemIDplus |
| Citations |
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