Chem
J-GLOBAL ID：200907043950764644   Nikkaji number：J564.406B

4-[4-[3-(Trifluoromethyl)phenyl]piperazino]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole

4-[4-[3-(トリフルオロメチル)フェニル]ピペラジノ]-7,8-ジメトキシ-5H-ピリミド[5,4-b]インドール
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： C23H22F3N5O2
Molecular formula furigana： C23-H22-F3-N5-O2
Molecular weight： 457.457
InChI： InChI=1S/C23H22F3N5O2/c1-32-18-11-16-17(12-19(18)33-2)29-21-20(16)27-13-28-22(21)31-8-6-30(7-9-31)15-5-3-4-14(10-15)23(24,25)26/h3-5,10-13,29H,6-9H2,1-2H3
InChI key： JRRZVTVWAISKIX-UHFFFAOYSA-N
SMILES： COc1cc2[nH]c3c(ncnc3c2cc1OC)N1CCN(CC1)c1cccc(c1)C(F)(F)F
Systematic name  (3)：
  • 4-[4-[3-(トリフルオロメチル)フェニル]ピペラジノ]-7,8-ジメトキシ-5H-ピリミド[5,4-b]インドール
  • 1-{7,8-ジメトキシ-5H-ピリミド[5,4-b]インドール-4-イル}-4-[3-(トリフルオロメチル)フェニル]ピペラジン
  • 1-{7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-yl}-4-[3-(trifluoromethyl)phenyl]piperazine
Other name (1)：
  • 4-[4-[3-(Trifluoromethyl)phenyl]piperazino]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
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