Account 2-(3-(4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetonitrile 2,2,2-trifluoroacetate
- Catalog No. :
- ACWLAP122
- CAS No. :
- 1187594-10-0
- Molecular Formula :
- C18H18F3N7O4S
- Molecular Weight :
- 485.45
IUPAC Name:2-(3-(4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetonitrile 2,2,2-trifluoroacetate
![2-(3-(4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetonitrile 2,2,2-trifluoroacetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 2-(3-(4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetonitrile 2,2,2-trifluoroacetate |
|---|---|
| IUPAC Name | 2-(3-(4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetonitrile 2,2,2-trifluoroacetate |
| Molecular Formula | C18H18F3N7O4S |
| Molecular Weight | 485.45 |
| SMILES | N#CCC1(N2N=CC(C3=C4C(NC=C4)=NC=N3)=C2)CN(S(=O)(CC)=O)C1.O=C(O)C(F)(F)F |
| InChI Key | SRBRRMLIGZDAQK-UHFFFAOYSA-N |
| Synonym | Baricitinib IMP;Baricitinib trifluoroacetate;Baricitinib Impurity;{1-Ethanesulfonyl-3-[4-(7-hydroxymethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrazol-1-yl]-azetidin-3-yl}-acetonitrile;2-{1-Ethanesulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrazol-1-yl]-azetidin-3-yl}-acetamide;{1-Ethanesulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrazol-1-yl]-azetidin-3-yl}-acetic acid;{1-Ethanesulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)-pyrazol-1-yl]-azetidin-3-yl}-acetonitrile;[3-(4-{2-[1-(3-Cyanomethyl-1-ethanesulfonyl-azetidin-3-yl)-1H-pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}-pyrazol-1-yl)-1-ethanesulfonyl-azetidin-3-yl]-acetonitrile |
| CAS No. | 1187594-10-0 |
Synthetic Route by SureRoute
2. ACWLAP122 Molecular Building Block Synthetic Route
2-(3-(4-(7H-Pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetonitrile phosphate
2-(3-(4-(7H-Pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(cyclopropylsulfonyl)azetidin-3-yl)acetonitrile
2-(3-(4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetic acid