Chem
J-GLOBAL ID：201407081106093997   Nikkaji number：J3.311.001D

Toceranib

トセラニブ
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： C22H25FN4O2
Molecular formula furigana： C22-H25-F-N4-O2
Molecular weight： 396.466
InChI： InChI=1S/C22H25FN4O2/c1-13-19(12-17-16-11-15(23)5-6-18(16)26-21(17)28)25-14(2)20(13)22(29)24-7-10-27-8-3-4-9-27/h5-6,11-12,25H,3-4,7-10H2,1-2H3,(H,24,29)(H,26,28)/b17-12-
InChI key： SRSGVKWWVXWSJT-ATVHPVEESA-N
SMILES： Cc1[nH]c(/C=C/2\C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NCCN1CCCC1
Systematic name  (3)：
  • N-[2-(ピロリジン-1-イル)エチル]-5-[(Z)-(2,3-ジヒドロ-2-オキソ-5-フルオロ-1H-インドール-3-イリデン)メチル]-2,4-ジメチル-1H-ピロール-3-カルボアミド
  • 5-{[(3Z)-5-フルオロ-2-オキソ-2,3-ジヒドロ-1H-インドール-3-イリデン]メチル}-2,4-ジメチル-N-[2-(ピロリジン-1-イル)エチル]-1H-ピロール-3-カルボキサミド
  • 5-{[(3Z)-5-fluoro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-2,4-dimethyl-N-[2-(pyrrolidin-1-yl)ethyl]-1H-pyrrole-3-carboxamide
Other name (3)：
  • トセラニブ
  • Toceranib
  • N-[2-(Pyrrolidine-1-yl)ethyl]-5-[(Z)-(2,3-dihydro-2-oxo-5-fluoro-1H-indole-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide
CAS registry number： 356068-94-5
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