Account (2R,3R,4R,5R)-2-(Acetoxymethyl)-5-(6-(N-(2-(methylthio)ethyl)acetamido)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate
- Catalog No. :
- ACQIBE158
- CAS No. :
- 163706-57-8
- Molecular Formula :
- C24H30F3N5O8S2
- Molecular Weight :
- 637.66
IUPAC Name:(2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-(N-(2-(methylthio)ethyl)acetamido)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate
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Product Information
| Product Name | (2R,3R,4R,5R)-2-(Acetoxymethyl)-5-(6-(N-(2-(methylthio)ethyl)acetamido)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate |
|---|---|
| IUPAC Name | (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-(N-(2-(methylthio)ethyl)acetamido)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate |
| Molecular Formula | C24H30F3N5O8S2 |
| Molecular Weight | 637.66 |
| SMILES | FC(F)(F)CCSC1=NC(N(CCSC)C(C)=O)=C2N=CN([C@H]3[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O3)C2=N1 |
| InChI Key | XPSVMYGHHCBFMJ-WGQQHEPDSA-N |
| Synonym | (2R,3R,4R)-2-(acetoxyMethyl)-5-(6-(N-(2-(Methylthio)ethyl)acetaMido)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate;Adenosine, N-acetyl-N-[2-(methylthio)ethyl]-2-[(3,3,3-trifluoropropyl)thio]-, 2',3',5'-triacetate(9CI);Adenosine, N-acetyl-N-[2-(methylthio)ethyl]-2-[(3,3,3-trifluoropropyl)thio]-, 2',3',5'-triacetate;Cangrelor Impurity 12;Cangrelor Impurity 3Q: What is Cangrelor Impurity 3 Q: What is the CAS Number of Cangrelor Impurity 3 |
| CAS No. | 163706-57-8 |
Synthetic Route by SureRoute
2. ACQIBE158 Molecular Building Block Synthetic Route
(2R,3R,4R,5R)-2-(6-acetamido-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)-5-(acetoxymethyl)tetrahydrofuran-3,4-diyl diacetate
(2R,3S,4R,5R)-2-(Hydroxymethyl)-5-(6-((2-(methylthio)ethyl)amino)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diol
((2R,3S,4R,5R)-3,4-Dihydroxy-5-(6-((2-(methylthio)ethyl)amino)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-2-yl)methyl dihydrogen phosphate