Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{4-[(4-ethoxyphenoxy)methyl]phenyl}methanone
Catalog ID
STK302640
SMILES CCOc1ccc(cc1)OCc1ccc(cc1)C(=O)N1N=C(CC1(O)C(F)F)C(F)F
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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 C21H20F4N2O4 MW 440.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F4N2O4/c1-2-30-15-7-9-16(10-8-15)31-12-13-3-5-14(6-4-13)19(28)27-21(29,20(24)25)11-17(26-27)18(22)23/h3-10,18,20,29H,2,11-12H2,1H3InChIKey
GKEUEWHOBCVURT-UHFFFAOYSA-NSynonyms
681007-04-5(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(4((4ethoxyphenoxy)methyl)phenyl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(4((4ETHOXYPHENOXY)METHYL)PHENYL)METHANONE
35BIS(DIFLUOROMETHYL)1(4((4ETHOXYPHENOXY)METHYL)BENZOYL)45DIHYDRO1HPYRAZOL5OL
681007045
CCOC1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)N3C(CC(=N3)C(F)F)(C(F)F)O
InChI=1SC21H20F4N2O4c1230157916(10815)3112133514(6413)19(28)2721(2920(24)25)1117(2627)18(22)23h310182029H21112H21H3
MFCD04048315
ZINC000000652728
ZINC000000652729
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