Vitas-M small molecule compound
{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Catalog ID
STK302706
SMILES COc1ccc(cc1COc1ccc(cc1)Cl)C(=O)N1N=C(CC1(O)C(F)(F)F)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 C20H18ClF3N2O4 MW 442.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClF3N2O4/c1-12-10-19(28,20(22,23)24)26(25-12)18(27)13-3-8-17(29-2)14(9-13)11-30-16-6-4-15(21)5-7-16/h3-9,28H,10-11H2,1-2H3InChIKey
RQSPXSWBFMZVSG-UHFFFAOYSA-NSynonyms
723254-24-8(3((4chlorophenoxy)methyl)4methoxyphenyl)(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)methanone
(3((4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)METHANONE
1(3((4CHLOROPHENOXY)METHYL)4METHOXYBENZOYL)3METHYL5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL5OL
723254248
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)Cl
InChI=1SC20H18ClF3N2O4c1121019(2820(2223)24)26(2512)18(27)133817(292)14(913)1130166415(21)5716h3928H1011H212H3
MFCD04048272
ZINC000000655825
ZINC000000655828
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