Account Benzyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate
- Catalog No. :
- ACANFN991
- CAS No. :
- 159878-04-3
- Molecular Formula :
- C32H45N3O4S
- Molecular Weight :
- 567.80
IUPAC Name:benzyl ((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 | Benzyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate |
|---|---|
| IUPAC Name | benzyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbamate |
| Molecular Formula | C32H45N3O4S |
| Molecular Weight | 567.80 |
| SMILES | O=C(OCC1=CC=CC=C1)N[C@@H](CSC2=CC=CC=C2)[C@H](O)CN3C[C@@]4([H])CCCC[C@@]4([H])C[C@H]3C(NC(C)(C)C)=O |
| InChI Key | CADGDESSNWSRRZ-RIVMDFSBSA-N |
| Synonym | [3S-(3S,4aS,8aS,2’R,3’R)]-2-[3’-N-CBz-amino-2’-hydroxy-4’-(phenyl)thio]butyldecahydroisoquinoline-3-N-t-butylcarboxamide;[(1R,2R)-3-[(3S,4aS,8aS)-3-[[(1,1-DiMethylethyl)aMino]carbonyl]octahydro-2(1H)-isoquinolinyl]-2-hydroxy-1-[(phenylthio)Methyl]propyl]carbaMic Acid PhenylMethyl Ester;benzyl ((2R,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbaMoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-(phenylthio)butan-2-yl)carbaMate;[3S-(3S,4aS,8aS,2'R,3'R)]-2-[3'-N-CBz-amino-2'-hydroxy-4'-(phenyl)thio]butyldecahydroisoquinoline-3-N-t-butylcarboxamide-8;Nelfinavir O-Benzyl;Carbamic acid, N-[(1R,2R)-3-[(3S,4aS,8aS)-3-[[(1,1-dimethylethyl)amino]carbonyl]octahydro-2(1H)-isoquinolinyl]-2-hydroxy-1-[(phenylthio)methyl]propyl]-, phenylmethyl ester |
| CAS No. | 159878-04-3 |
Synthetic Route by SureRoute
2. ACANFN991 Molecular Building Block Synthetic Route
Rel-tert-butyl ((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
benzyl ((S)-4-amino-1-(((2S,3R)-4-((3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl)-3-hydroxy-1-phenylbutan-2-yl)amino)-1,4-dioxobutan-2-yl)carbamate