Vitas-M small molecule compound

[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl][5-(4-methoxyphenyl)-1H-pyrazol-3-yl]methanone

Catalog ID
STL394115
SMILES COc1ccc(cc1)c1[nH]nc(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 C16H14F4N4O3 MW 386.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F4N4O3/c1-27-9-4-2-8(3-5-9)10-6-11(22-21-10)14(25)24-16(26,15(19)20)7-12(23-24)13(17)18/h2-6,13,15,26H,7H2,1H3,(H,21,22)
InChIKey
BDBJWIJLOZFIPN-UHFFFAOYSA-N
Synonyms
1039008-06-4
(35BIS(DIFLUOROMETHYL)5HYDROXY45DIHYDRO1HPYRAZOL1YL)(5(4METHOXYPHENYL)1HPYRAZOL3YL)METHANONE
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(3(4METHOXYPHENYL)1HPYRAZOL5YL)METHANONE
1039008064
COC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3C(CC(=N3)C(F)F)(C(F)F)O
COc1ccc(cc1)c1(nH)nc(c1)C(=O)N1N=C(CC1(O)C(F)F)C(F)F
InChI=1SC16H14F4N4O3c1279428(359)10611(222110)14(25)2416(2615(19)20)712(2324)13(17)18h26131526H7H21H3(H2122)
MFCD04050041
ZINC000008492817
ZINC000008492819

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Available files

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