Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl](5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}furan-2-yl)methanone
Catalog ID
STK302457
SMILES Cc1ccc(c(c1)OCc1ccc(o1)C(=O)N1N=C(CC1(O)C(F)F)C(F)F)C(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H22F4N2O4 MW 442.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F4N2O4/c1-11(2)14-6-4-12(3)8-17(14)30-10-13-5-7-16(31-13)19(28)27-21(29,20(24)25)9-15(26-27)18(22)23/h4-8,11,18,20,29H,9-10H2,1-3H3InChIKey
BKPKOMQXPICDOL-UHFFFAOYSA-NSynonyms
512825-00-2(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(5((5methyl2(propan2yl)phenoxy)methyl)furan2yl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(5((5METHYL2PROPAN2YLPHENOXY)METHYL)FURAN2YL)METHANONE
35BIS(DIFLUOROMETHYL)1(5((2ISOPROPYL5METHYLPHENOXY)METHYL)2FUROYL)45DIHYDRO1HPYRAZOL5OL
512825002
CC1=CC(=C(C=C1)C(C)C)OCC2=CC=C(O2)C(=O)N3C(CC(=N3)C(F)F)(C(F)F)O
InChI=1SC21H22F4N2O4c111(2)146412(3)817(14)3010135716(3113)19(28)2721(2920(24)25)915(2627)18(22)23h4811182029H910H213H3
MFCD03468610
ZINC000000653295
ZINC000000653298
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