Chem
J-GLOBAL ID：201107029551725835   Nikkaji number：J2.909.089K

1-[3-(Trifluoromethyl)phenyl]-3-[2-fluoro-4-(5-methyl-5H-pyrrolo[3,2-d]pyrimidine-4-yloxy)phenyl]urea

1-[3-(トリフルオロメチル)フェニル]-3-[2-フルオロ-4-(5-メチル-5H-ピロロ[3,2-d]ピリミジン-4-イルオキシ)フェニル]尿素
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： C21H15F4N5O2
Molecular formula furigana： C21-H15-F4-N5-O2
Molecular weight： 445.378
InChI： InChI=1S/C21H15F4N5O2/c1-30-8-7-17-18(30)19(27-11-26-17)32-14-5-6-16(15(22)10-14)29-20(31)28-13-4-2-3-12(9-13)21(23,24)25/h2-11H,1H3,(H2,28,29,31)
InChI key： TWOLOZGQZKJZKJ-UHFFFAOYSA-N
SMILES： Cn1ccc2ncnc(Oc3ccc(NC(=O)Nc4cccc(c4)C(F)(F)F)c(F)c3)c12
Systematic name  (3)：
  • 1-[3-(トリフルオロメチル)フェニル]-3-[2-フルオロ-4-(5-メチル-5H-ピロロ[3,2-d]ピリミジン-4-イルオキシ)フェニル]尿素
  • 3-[2-フルオロ-4-({5-メチル-5H-ピロロ[3,2-d]ピリミジン-4-イル}オキシ)フェニル]-1-[3-(トリフルオロメチル)フェニル]尿素
  • 3-[2-fluoro-4-({5-methyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl}oxy)phenyl]-1-[3-(trifluoromethyl)phenyl]urea
Other name (1)：
  • 1-[3-(Trifluoromethyl)phenyl]-3-[2-fluoro-4-(5-methyl-5H-pyrrolo[3,2-d]pyrimidine-4-yloxy)phenyl]urea
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