Chemical Compound

3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1-((5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-1H-1,2,4-triazol-5(4H)-one

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3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1-((5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-1H-1,2,4-triazol-5(4H)-one 结构式
Primary record

3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1-((5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-1H-1,2,4-triazol-5(4H)-one

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
176476525
SMILES
C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@@H](N(CCO2)CC3=NN(C(=O)N3)CC4=NNC(=O)N4)C5=CC=C(C=C5)F
Canonical SMILES
C[C@@H](O[C@H]1OCCN(Cc2nn(Cc3n[nH]c(=O)[nH]3)c(=O)[nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

名称与同义词

  • Aprepitant Impurity 76
  • Fosaprepitant Impurity 52
  • 3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1-((5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-1H-1,2,4-triazol-5(4H)-one