CAS 2089321-00-4 is the registry number for VT-1598 (tosylate). Offered by: MedChemExpress. Available pack sizes: Get quote.
4-[[4-[2-[6-[(2R)-2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(tetrazol-1-yl)propyl]-3-pyridinyl]ethynyl]phenoxy]methyl]benzonitrile;4-methylbenzenesulfonic acid (CAS 2089321-00-4) is a chemical compound with the molecular formula C38H28F4N6O5S and a molecular weight of 756.7 g/mol. IUPAC name: 4-[[4-[2-[6-[(2R)-2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(tetrazol-1-yl)propyl]-3-pyridinyl]ethynyl]phenoxy]methyl]benzonitrile;4-methylbenzenesulfonic acid. InChIKey: GKPRUVVZIHFHMK-CZCBIWLKSA-N.
| Molecular formula | C38H28F4N6O5S |
|---|---|
| Molecular weight | 756.7 g/mol |
| IUPAC name | 4-[[4-[2-[6-[(2R)-2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(tetrazol-1-yl)propyl]-3-pyridinyl]ethynyl]phenoxy]methyl]benzonitrile;4-methylbenzenesulfonic acid |
| InChIKey | GKPRUVVZIHFHMK-CZCBIWLKSA-N |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=CC=C1COC2=CC=C(C=C2)C#CC3=CN=C(C=C3)C([C@](CN4C=NN=N4)(C5=C(C=C(C=C5)F)F)O)(F)F)C#N |
Computed by PubChem (NCBI)