Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{3-[(4-ethoxyphenoxy)methyl]phenyl}methanone
Catalog ID
STK967671
SMILES CCOc1ccc(cc1)OCc1cccc(c1)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/c1-2-30-15-6-8-16(9-7-15)31-12-13-4-3-5-14(10-13)19(28)27-21(29,20(24)25)11-17(26-27)18(22)23/h3-10,18,20,29H,2,11-12H2,1H3InChIKey
QHYYQTGNPDPITI-UHFFFAOYSA-NSynonyms
723252-81-1(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(3((4ethoxyphenoxy)methyl)phenyl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(3((4ETHOXYPHENOXY)METHYL)PHENYL)METHANONE
35BIS(DIFLUOROMETHYL)1(3((4ETHOXYPHENOXY)METHYL)BENZOYL)45DIHYDRO1HPYRAZOL5OL
723252811
CCOC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)N3C(CC(=N3)C(F)F)(C(F)F)O
InChI=1SC21H20F4N2O4c1230156816(9715)31121343514(1013)19(28)2721(2920(24)25)1117(2627)18(22)23h310182029H21112H21H3
MFCD04048318
ZINC000000652705
ZINC000000652709
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