Chemical Compound

SCHEMBL12991590

CAS Registry Number 219821-37-1
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SCHEMBL12991590 chemical structure
Primary Record

SCHEMBL12991590

In stock
2,322 g
Purity
99.8 %
CAS
219821-37-1

Compound Identifiers & Properties

CAS
219821-37-1
PubChem CID
10289793
SMILES
CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(N(CCO2)C/C(=N/NC(=O)OC)/N)C3=CC=C(C=C3)F
Canonical SMILES
COC(=O)N/N=C(\N)CN1CCOC(OC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1c1ccc(F)cc1

Names & Synonyms

  • SCHEMBL12991590
  • CID10289793
  • Aprepitant open-ring methyl ester impurity
  • CID 11455865
  • 219821-37-1