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teriflunomide
A carboxamide obtained by formal condensation of the carboxy group of (2Z)-2-cyano-3-hydroxybut-2-enoic acid with the anilino group of 4-(trifluoromethyl)aniline. Used for the treatment of relapsing forms of multiple sclerosis and rheumatoid arthritis.


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03. Biological Effects of Specific Chemicals: biochemical uses [CHEBI:52206] > metabolite [CHEBI:25212] > drug metabolite [CHEBI:49103]
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05. Industrial Uses: pharmaceutical [CHEBI:52217] > drug [CHEBI:23888]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 biochemical uses [CHEBI:52206] (3306) 
 enzyme inhibitor [CHEBI:23924] (825) 
 dihydroorotate dehydrogenase inhibitor [CHEBI:68542] (2) 
 teriflunomide [CHEBI:68540] (1)
 protein kinase inhibitor [CHEBI:37699] (69) 
 tyrosine kinase inhibitor [CHEBI:38637] (38) 
 teriflunomide [CHEBI:68540] (1)
 metabolite [CHEBI:25212] (2692) 
 drug metabolite [CHEBI:49103] (17) 
 teriflunomide [CHEBI:68540] (1)
 aetiopathogenetic uses [CHEBI:52209] (178) 
 hepatotoxic agent [CHEBI:50908] (8) 
 teriflunomide [CHEBI:68540] (1)
05. Industrial Uses 
05. Industrial Uses
 pharmaceutical [CHEBI:52217] (1978) 
 drug [CHEBI:23888] (1930) 
 anti-inflammatory drug [CHEBI:35472] (112) 
 non-steroidal anti-inflammatory drug [CHEBI:35475] (71) 
 teriflunomide [CHEBI:68540] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 s-block molecular entity [CHEBI:33674] (7287) 
 hydrogen molecular entity [CHEBI:33608] (6932) 
 hydroxides [CHEBI:24651] (5641) 
 organic hydroxy compound [CHEBI:33822] (3050) 
 enol [CHEBI:33823] (52) 
 teriflunomide [CHEBI:68540] (1)
 p-block molecular entity [CHEBI:33675] (25343) 
 halogen molecular entity [CHEBI:24471] (1475) 
 fluorine molecular entity [CHEBI:24062] (288) 
 organofluorine compound [CHEBI:37143] (275) 
 teriflunomide [CHEBI:68540] (1)
 halide [CHEBI:37578] (1402) 
 organohalogen compound [CHEBI:36684] (976) 
 organofluorine compound [CHEBI:37143] (275) 
 teriflunomide [CHEBI:68540] (1)
 pnictogen molecular entity [CHEBI:33302] (10027) 
 nitrogen molecular entity [CHEBI:51143] (7930) 
 amide [CHEBI:32988] (1863) 
 primary amide [CHEBI:33256] (1586) 
 carboxamide [CHEBI:37622] (1381) 
 teriflunomide [CHEBI:68540] (1)
 organonitrogen compound [CHEBI:35352] (6705) 
 cyanides [CHEBI:23424] (120) 
 nitrile [CHEBI:18379] (117) 
 teriflunomide [CHEBI:68540] (1)
 carboxamide [CHEBI:37622] (1381) 
 teriflunomide [CHEBI:68540] (1)
 chalcogen molecular entity [CHEBI:33304] (15225) 
 oxygen molecular entity [CHEBI:25806] (14414) 
 hydroxides [CHEBI:24651] (5641) 
 organic hydroxy compound [CHEBI:33822] (3050) 
 enol [CHEBI:33823] (52) 
 teriflunomide [CHEBI:68540] (1)
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 teriflunomide [CHEBI:68540] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 teriflunomide [CHEBI:68540] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organonitrogen compound [CHEBI:35352] (6705) 
 cyanides [CHEBI:23424] (120) 
 nitrile [CHEBI:18379] (117) 
 teriflunomide [CHEBI:68540] (1)
 carboxamide [CHEBI:37622] (1381) 
 teriflunomide [CHEBI:68540] (1)
 organohalogen compound [CHEBI:36684] (976) 
 organofluorine compound [CHEBI:37143] (275) 
 teriflunomide [CHEBI:68540] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 teriflunomide [CHEBI:68540] (1)
 organic hydroxy compound [CHEBI:33822] (3050) 
 enol [CHEBI:33823] (52) 
 teriflunomide [CHEBI:68540] (1)
 polyatomic entity [CHEBI:36357] (18777) 
 heteroatomic molecular entity [CHEBI:37577] (13672) 
 hydroxides [CHEBI:24651] (5641) 
 organic hydroxy compound [CHEBI:33822] (3050) 
 enol [CHEBI:33823] (52) 
 teriflunomide [CHEBI:68540] (1)
 halide [CHEBI:37578] (1402) 
 organohalogen compound [CHEBI:36684] (976) 
 organofluorine compound [CHEBI:37143] (275) 
 teriflunomide [CHEBI:68540] (1)
ChEBI Compound Accession Identifier  [CHEBI:68540]
ChEBI Compound Description  A carboxamide obtained by formal condensation of the carboxy group of (2Z)-2-cyano-3-hydroxybut-2-enoic acid with the anilino group of 4-(trifluoromethyl)aniline. Used for the treatment of relapsing forms of multiple sclerosis and rheumatoid arthritis.
ChEBI Compound Identification Number  68540
ChEBI InChI Value  InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7-
ChEBI InChIKey Value  UTNUDOFZCWSZMS-YFHOEESVSA-N
ChEBI Compound Name  teriflunomide
ChEBI SMILES Value  C\\C(O)=C(/C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
ChEBI Substance ID  160645856
ChEBI URL  ChEBI:68540
ChemSpider ID  16737143
Ontomatica Chemical Accession Key (OnChAKey)  UTNUDOFZCWSZMS_YFHOEESVSA_N_000_000000
PubChem Compound ID  54684141