Chemical Compound

Fosaprepitant Impurity 1

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Fosaprepitant Impurity 1 chemical structure
Primary Record

Fosaprepitant Impurity 1

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
135999794
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)P(=O)(OC)OC)C4=CC=C(C=C4)F
Canonical SMILES
COP(=O)(OC)n1nc(CN2CCO[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccc(F)cc2)[nH]c1=O

Names & Synonyms

  • Fosaprepitant Impurity 1
  • SCHEMBL12748225
  • FSMXZUUOYREGAI-YKAGIRRDSA-N
  • 5-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-2-dimethoxyphosphoryl-4H-1,2,4-triazol-3-one
  • dimethyl (3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-5-oxo-2,5-dihydro-1H-1,2,4-triazol-1-yl)phosphonate