Products 2789680-32-4
CAS 2789680-32-4 is the registry number for Baricitinib 4-aminobenzoic acid (TFA). Offered by: MedChemExpress. Available pack sizes: Get quote.
4-[[4-[1-[3-(cyanomethyl)-1-ethylsulfonylazetidin-3-yl]pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzoic acid;2,2,2-trifluoroacetic acid (CAS 2789680-32-4) is a chemical compound with the molecular formula C25H23F3N8O6S and a molecular weight of 620.6 g/mol. IUPAC name: 4-[[4-[1-[3-(cyanomethyl)-1-ethylsulfonylazetidin-3-yl]pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzoic acid;2,2,2-trifluoroacetic acid. InChIKey: FKOOYPQIKKEFAV-UHFFFAOYSA-N.
| Molecular formula | C25H23F3N8O6S |
|---|---|
| Molecular weight | 620.6 g/mol |
| IUPAC name | 4-[[4-[1-[3-(cyanomethyl)-1-ethylsulfonylazetidin-3-yl]pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzoic acid;2,2,2-trifluoroacetic acid |
| InChIKey | FKOOYPQIKKEFAV-UHFFFAOYSA-N |
| SMILES | CCS(=O)(=O)N1CC(C1)(CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC(=N3)NC5=CC=C(C=C5)C(=O)O.C(=O)(C(F)(F)F)O |
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