Vitas-M small molecule compound

{3-[(2,3-dichlorophenoxy)methyl]-4-methoxyphenyl}[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone

Catalog ID
STK302708
SMILES COc1ccc(cc1COc1cccc(c1Cl)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 C20H17Cl2F3N2O4 MW 477.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2F3N2O4/c1-11-9-19(29,20(23,24)25)27(26-11)18(28)12-6-7-15(30-2)13(8-12)10-31-16-5-3-4-14(21)17(16)22/h3-8,29H,9-10H2,1-2H3
InChIKey
JWUCRUOCACXJIM-UHFFFAOYSA-N
Synonyms
723254-26-0
(3((23dichlorophenoxy)methyl)4methoxyphenyl)(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)methanone
(3((23DICHLOROPHENOXY)METHYL)4METHOXYPHENYL)(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)METHANONE
1(3((23DICHLOROPHENOXY)METHYL)4METHOXYBENZOYL)3METHYL5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL5OL
723254260
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC(=C(C=C2)OC)COC3=C(C(=CC=C3)Cl)Cl
InChI=1SC20H17Cl2F3N2O4c111919(2920(2324)25)27(2611)18(28)126715(302)13(812)10311653414(21)17(16)22h3829H910H212H3
MFCD04048335
ZINC000000655838
ZINC000000655840

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Available files

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