Chem
J-GLOBAL ID：200907067995360168   Nikkaji number：J373.686E

E-Teriflunomide

E-テリフルノミド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H9F3N2O2
Molecular formula furigana： C12-H9-F3-N2-O2
Molecular weight： 270.211
InChI： 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+
InChI key： UTNUDOFZCWSZMS-JXMROGBWSA-N
SMILES： C/C(=C(/C#N)\C(=O)Nc1ccc(cc1)C(F)(F)F)/O
Systematic name  (4)：
  • (E)-2-シアノ-3-ヒドロキシ-N-(4-トリフルオロメチルフェニル)-2-ブテンアミド
  • (2E)-N-[4-(トリフルオロメチル)フェニル]-2-シアノ-3-ヒドロキシ-2-ブテンアミド
  • (2E)-2-シアノ-3-ヒドロキシ-N-[4-(トリフルオロメチル)フェニル]ブタ-2-エンアミド
  • (2E)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-enamide
Other name (4)：
  • (2E)-N-[4-(Trifluoromethyl)phenyl]-2-cyano-3-hydroxy-2-buteneamide
  • (E)-2-Cyano-3-hydroxy-N-(4-trifluoromethylphenyl)-2-butenamide
  • E-テリフルノミド
  • E-Teriflunomide
CAS registry number： 214782-56-6
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