Catalog Number | R022108 |
CAS Number | 81886-51-3 |
Synonyms | α-(4-Fluorophenyl)-α-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4-Triazole-1-ethanol; USP Fluconazole Related Compound B; |
Molecular Formula | C13H13FN6O |
Purity | ≥95% |
Storage | -20°C |
IUPAC Name | 2-(4-fluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol |
InChI | InChI=1S/C13H13FN6O/c14-12-3-1-11(2-4-12)13(21,5-19-9-15-7-17-19)6-20-10-16-8-18-20/h1-4,7-10,21H,5-6H2 |
InChIKey | HUEOBFHUKGPCHO-UHFFFAOYSA-N |
SMILES | C1=CC(=CC=C1C(CN2C=NC=N2)(CN3C=NC=N3)O)F |