Account Rel-tert-butyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate
- Catalog No. :
- ACXDHO030
- CAS No. :
- 1217629-57-6
- Molecular Formula :
- C29H47N3O4S
- Molecular Weight :
- 533.78
IUPAC Name:tert-butyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate
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Product Information
| Product Name | Rel-tert-butyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate |
|---|---|
| IUPAC Name | tert-butyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate |
| Molecular Formula | C29H47N3O4S |
| Molecular Weight | 533.78 |
| SMILES | O=C(OC(C)(C)C)N[C@H]([C@H](O)CN1C[C@@]2([H])CCCC[C@@]2([H])C[C@H]1C(NC(C)(C)C)=O)CSC3=CC=CC=C3 |
| InChI Key | IAYMVYNHFPZOOB-PZNJWVMQSA-N |
| Synonym | [3S-(3R,4aR,8aR,2’S,3’S)]-2-[3’-N-t-Boc-amino-2’-hydroxy-4’-(phenyl)thio]butyldecahydroisoquinoline-3-N-t-butylcarboxamide;Nelfinavir O-t-Butylcarboxamide;Carbamic acid, N-[(1S,2S)-3-[(3R,4aR,8aR)-3-[[(1,1-dimethylethyl)amino]carbonyl]octahydro-2(1H)-isoquinolinyl]-2-hydroxy-1-[(phenylthio)methyl]propyl]-, 1,1-dimethylethyl ester, rel- |
| CAS No. | 1217629-57-6 |
Synthetic Route by SureRoute
2. ACXDHO030 Molecular Building Block Synthetic Route
Benzyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate
(3S,4AS,8aS)-2-((2R,3R)-3-amino-2-hydroxy-4-(phenylthio)butyl)-N-(tert-butyl)decahydroisoquinoline-3-carboxamide
(3S,4aS,8aS)-N-(tert-Butyl)-2-((2R,3R)-2-hydroxy-3-(3-hydroxy-2-methylbenzamido)-4-(phenylthio)butyl)decahydroisoquinoline-3-carboxamide