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Aprepitant

(The order shall be subject to the English name)

English alias:Aprepitant; 5-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one; Emend; Emend (TN); [3H]-Aprepitant; 5-[{(2R,3S)-2-((1R)-1-3,5-bis(trifluoro-methyl)phenylethoxy)-3-(4-fluorophenyl)-4-morpholinyl}methyl]-1,2-dihydro-3H-1,2,4-triazol-3-one; MK-0869; MK-869; Emend (Trade Name);
CAS:170729-80-3 Molecular formula:C₂₃H₂₁F₇N₄O₃ Molecular weight:534.43 MDL:MFCD08277635

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Name:
Aprepitant
CAS No.:
170729-80-3
Molecular formula:
C₂₃H₂₁F₇N₄O₃
Molecular weight:
534.43
InChIKey:
ATALOFNDEOCMKK-OITMNORJSA-N
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
Pubchem ID:
Dangerous goods sign:
Xn; Xi
SignalWord:
Warning
HazardStatement:
H302-H315-H319-H335
WarningStatement:
P261-P305+P351+P338
WGK Germany:
3
DangerCode:
R20/21/22; R36/37/38
SafetyInstructions:
S26; S36
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