Primary Record
Aprepitant
- In stock
- 7,788 g
- Purity
- 98.3 %
- CAS
- 170729-80-3
Compound Identifiers & Properties
- CAS
- 170729-80-3
- PubChem CID
- 137179497
- SMILES
- CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@](C2=CC=C(C=C2)F)(C3=NNC(=O)N3)N4CCOCC4
- Canonical SMILES
- CC(O[C@](c1ccc(F)cc1)(c1n[nH]c(=O)[nH]1)N1CCOCC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
Names & Synonyms
- Aprepitant
- 170729-80-3