Account 5-(((2S,3S)-2-((S)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,4-triazol-3(2H)-one
- Catalog No. :
- ACEZGC358
- CAS No. :
- 1242175-40-1
- Molecular Formula :
- C23H21F7N4O3
- Molecular Weight :
- 534.43
IUPAC Name:5-(((2S,3S)-2-((S)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
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Product Information
| Product Name | 5-(((2S,3S)-2-((S)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,4-triazol-3(2H)-one |
|---|---|
| IUPAC Name | 5-(((2S,3S)-2-((S)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Formula | C23H21F7N4O3 |
| Molecular Weight | 534.43 |
| SMILES | O=C1NNC(CN2[C@@H](C3=CC=C(F)C=C3)[C@H](O[C@H](C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)C)OCC2)=N1 |
| InChI Key | ATALOFNDEOCMKK-OUWQEXSBSA-N |
| Synonym | Aprepitant Impurity 5;Aprepitant impurity 10/(S,S,S)-Aprepitant;Arepitam impurity isomers (1S, 2S, 3S);Aprepitant (S,S,S)-Isomer;Aprepitant Impurity 7(S,S,S-Isomer);Aprepitant iMpurity 30;3H-1,2,4-Triazol-3-one, 5-[[(2S,3S)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-;5-(((2S,3S)-2-((S)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| CAS No. | 1242175-40-1 |
Synthetic Route by SureRoute
2. ACEZGC358 Molecular Building Block Synthetic Route
5-(((2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,4-triazol-3(2H)-one
3H-1,2,4-Triazol-3-one, 5-[[(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-
3H-1,2,4-Triazol-3-one, 5-[[(2R,3S)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-