CAS 2491661-50-6 is the registry number for Galectin-3-IN-3. Offered by: MedChemExpress. Available pack sizes: Get quote.
(2R,3R,4S,5R,6S)-6-[2-(1,3-benzothiazol-6-yl)-5-methyl-1,2,4-triazol-3-yl]-4-[4-(4-chloro-2,3-difluorophenyl)triazol-1-yl]-2-(hydroxymethyl)-5-methoxyoxan-3-ol (CAS 2491661-50-6) is a chemical compound with the molecular formula C25H22ClF2N7O4S and a molecular weight of 590.0 g/mol. IUPAC name: (2R,3R,4S,5R,6S)-6-[2-(1,3-benzothiazol-6-yl)-5-methyl-1,2,4-triazol-3-yl]-4-[4-(4-chloro-2,3-difluorophenyl)triazol-1-yl]-2-(hydroxymethyl)-5-methoxyoxan-3-ol. InChIKey: UWRDJBIKYULHHZ-JQSHXNIYSA-N.
| Molecular formula | C25H22ClF2N7O4S |
|---|---|
| Molecular weight | 590.0 g/mol |
| IUPAC name | (2R,3R,4S,5R,6S)-6-[2-(1,3-benzothiazol-6-yl)-5-methyl-1,2,4-triazol-3-yl]-4-[4-(4-chloro-2,3-difluorophenyl)triazol-1-yl]-2-(hydroxymethyl)-5-methoxyoxan-3-ol |
| InChIKey | UWRDJBIKYULHHZ-JQSHXNIYSA-N |
| SMILES | CC1=NN(C(=N1)[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)N3C=C(N=N3)C4=C(C(=C(C=C4)Cl)F)F)OC)C5=CC6=C(C=C5)N=CS6 |
Computed by PubChem (NCBI)