Vitas-M small molecule compound
methyl 3-[3-hydroxy-5-(2,4,5-trifluorobenzyl)-1H-pyrazol-4-yl]-3-(pyridin-3-yl)propanoate
Catalog ID
STL408826
SMILES COC(=O)CC(c1c([nH]nc1O)Cc1cc(F)c(cc1F)F)c1cccnc1
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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 C19H16F3N3O3 MW 391.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F3N3O3/c1-28-17(26)7-12(10-3-2-4-23-9-10)18-16(24-25-19(18)27)6-11-5-14(21)15(22)8-13(11)20/h2-5,8-9,12H,6-7H2,1H3,(H2,24,25,27)InChIKey
IDXVBAJUSJFLEU-UHFFFAOYSA-NSynonyms
1574517-29-51574517295
COC(=O)CC(C1=CN=CC=C1)C2=C(NNC2=O)CC3=CC(=C(C=C3F)F)F
COC(=O)CC(c1c((nH)nc1O)Cc1cc(F)c(cc1F)F)c1cccnc1
InChI=1SC19H16F3N3O3c12817(26)712(1032423910)1816(242519(18)27)611514(21)15(22)813(11)20h258912H67H21H3(H2242527)
methyl3(3hydroxy5(245trifluorobenzyl)1Hpyrazol4yl)3(pyridin3yl)propanoate
methyl3(3oxo5((245trifluorophenyl)methyl)12dihydropyrazol4yl)3pyridin3ylpropanoate
MFCD30705407
ZINC000096231724
ZINC000096231725
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