CH₃CH₃

Aprepitant

Chemistry

58 atoms · Conformer computed and published by PubChem.
Formula
C23H21F7N4O3
Molar mass
534.4 g/mol
IUPAC name
3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one
InChIKey
ATALOFNDEOCMKK-OITMNORJSA-N

Chemistry from PubChem CID 135413536.

Also known as

  • 170729-80-3
  • MK-869
  • MK-0869
  • Cinvanti
  • Aponvie
  • L-754030
  • ONO-7436
  • aprepitantum

Stereoisomers

8 distinct stereoisomers are registered for this structure.

  • Aprepitant this area CID 135413536
  • (2S,3S,1'R)-Aprepitant CID 135506334
  • 5-[[(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-1,2,4-triazol-3-one CID 135554441
  • (R,R,R)-Aprepitant CID 135925275
  • 5-(((2R,3R)-2-((S)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,4-triazol-3(2H)-one CID 135934917
  • [1(S)-Phenylethoxy]-Aprepitant CID 135934924
  • ent-Aprepitant CID 135934925
  • 5-(((2S,3S)-2-((S)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,4-triazol-3(2H)-one CID 135934937
  • (S,S,S)-Aprepitant mixture CID 135761774

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