Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl](3,5-dimethoxyphenyl)methanone
Catalog ID
STK431693
SMILES COc1cc(cc(c1)OC)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 C14H14F4N2O4 MW 350.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14F4N2O4/c1-23-8-3-7(4-9(5-8)24-2)12(21)20-14(22,13(17)18)6-10(19-20)11(15)16/h3-5,11,13,22H,6H2,1-2H3InChIKey
ROATXRYBFDKSDO-UHFFFAOYSA-NSynonyms
(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(35dimethoxyphenyl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(35DIMETHOXYPHENYL)METHANONE
35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)35DIMETHOXYPHENYLKETONE
COC1=CC(=CC(=C1)C(=O)N2C(CC(=N2)C(F)F)(C(F)F)O)OC
InChI=1SC14H14F4N2O4c123837(49(58)242)12(21)2014(2213(17)18)610(1920)11(15)16h35111322H6H212H3
MFCD03466524
ZINC000017072651
ZINC000017072652
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