Chem
J-GLOBAL ID：201107039116037213   Nikkaji number：J2.910.287B

Sorafenib N-oxide

ソラフェニブN-オキシド
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： C21H16ClF3N3[N+]O3[O-]
Molecular formula furigana： C21-H16-CL-F3-N4-O4
Molecular weight： 480.830
InChI： InChI=1S/C21H16ClF3N4O4/c1-26-19(30)18-11-15(8-9-29(18)32)33-14-5-2-12(3-6-14)27-20(31)28-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,27,28,31)
InChI key： BQAZCCVUZDIZDC-UHFFFAOYSA-N
SMILES： CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)cc[n+]1[O-]
Systematic name  (4)：
  • 4-[4-[3-[4-クロロ-3-(トリフルオロメチル)フェニル]ウレイド]フェノキシ]-2-(メチルカルバモイル)ピリジン1-オキシド
  • 4-[4-[3-[4-クロロ-3-(トリフルオロメチル)フェニル]ウレイド]フェノキシ]-2-(メチルアミノカルボニル)ピリジン1-オキシド
  • 4-[4-({[4-クロロ-3-(トリフルオロメチル)フェニル]カルバモイル}アミノ)フェノキシ]-2-(メチルカルバモイル)ピリジン-1-イウム-1-オラート
  • 4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-2-(methylcarbamoyl)pyridin-1-ium-1-olate
Other name (4)：
  • 4-[4-[3-[4-Chloro-3-(trifluoromethyl)phenyl]ureido]phenoxy]-2-(methylcarbamoyl)pyridine 1-oxide
  • ソラフェニブN-オキシド
  • Sorafenib N-oxide
  • 4-[4-[3-[4-Chloro-3-(trifluoromethyl)phenyl]ureido]phenoxy]-2-(methylaminocarbonyl)pyridine 1-oxide
Thsaurus map：
Thesaurus Map

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