Account Rel-((2R,5R)-5-(4-acetamido-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl benzoate
- Catalog No. :
- ACNTWW258
- CAS No. :
- 150796-39-7
- Molecular Formula :
- C17H16FN3O5S
- Molecular Weight :
- 393.40
IUPAC Name:((2R,5R)-5-(4-acetamido-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl benzoate
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Product Information
| Product Name | Rel-((2R,5R)-5-(4-acetamido-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl benzoate |
|---|---|
| IUPAC Name | ((2R,5R)-5-(4-acetamido-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl benzoate |
| Molecular Formula | C17H16FN3O5S |
| Molecular Weight | 393.40 |
| SMILES | CC(NC(C(F)=CN1[C@H]2CS[C@H](COC(C3=CC=CC=C3)=O)O2)=NC1=O)=O |
| InChI Key | HEPJFWWHRWALBV-ZIAGYGMSSA-N |
| Synonym | 4'-epi-EMtricitabine 4-AcetaMide 5'-O-Benzoyl;Emtricitabine N-Acetyl O-Benzoyl;Acetamide, N-[1-[(2R,5R)-2-[(benzoyloxy)methyl]-1,3-oxathiolan-5-yl]-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinyl]-, rel- (9CI);4′-epi-Emtricitabine 4-acetamide 5′-O-benzoyl, CAS 150796-39-7 |
| CAS No. | 150796-39-7 |
Synthetic Route by SureRoute
2. ACNTWW258 Molecular Building Block Synthetic Route
((2R,5S)-5-(4-acetamido-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl benzoate
((2R,5R)-5-(4-acetamido-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl benzoate
((2R,5S)-5-(4-Amino-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl benzoate