CAS: 172822-28-5 - 5-[[(2S,3S)-2-[(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-3H-1,2,4-triazol-3-one

Formula: C₂₃H₂₁F₇N₄O₃

InChI: InChI=1S/C23H21F7N4O3/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)37-20-19(13-2-4-17(24)5-3-13)34(6-7-36-20)11-18-31-21(35)33-32-18/h2-5,8-10,12,19-20H,6-7,11H2,1H3,(H2,31,32,33,35)/t12-,19+,20+/m1/s1

InChI key: InChIKey=ATALOFNDEOCMKK-CFGAKRJMSA-N

SMILES: O=C1NN=C(N1)CN2CCOC(OC(C=3C=C(C=C(C3)C(F)(F)F)C(F)(F)F)C)C2C4=CC=C(F)C=C4

(1R,2S,3S)-Aprepitant

CAS: 172822-28-5

• Formula: C₂₃H₂₁F₇N₄O₃
• Color and Shape: White To Off-White Solid
• Molecular weight: 534.43

(2S,3S,1’R)-Aprepitant

CAS: 172822-28-5

• Formula: C₂₃H₂₁F₇N₄O₃
• Color and Shape: Neat
• Molecular weight: 534.427

(2S,3S,1’R)-Aprepitant

CAS: 172822-28-5

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• Formula: C₂₃H₂₁F₇N₄O₃
• Purity: Min. 95%
• Molecular weight: 534.4 g/mol