Vitas-M small molecule compound
(3E)-4-(3-ethoxy-4-hydroxyphenyl)-3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]but-3-en-2-one
Catalog ID
STL393986
SMILES CCOc1cc(ccc1O)/C=C(/n1ccc(n1)C(F)(F)F)\C(=O)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 C16H15F3N2O3 MW 340.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F3N2O3/c1-3-24-14-9-11(4-5-13(14)23)8-12(10(2)22)21-7-6-15(20-21)16(17,18)19/h4-9,23H,3H2,1-2H3/b12-8+InChIKey
MPUVMJCWWWINGI-XYOKQWHBSA-NSynonyms
1006355-27-6(3E)4(3ETHOXY4HYDROXYPHENYL)3(3(TRIFLUOROMETHYL)1HPYRAZOL1YL)BUT3EN2ONE
(E)4(3ethoxy4hydroxyphenyl)3(3(trifluoromethyl)pyrazol1yl)but3en2one
1006355276
CCOC1=C(C=CC(=C1)C=C(C(=O)C)N2C=CC(=N2)C(F)(F)F)O
CCOc1cc(ccc1O)C=C(n1ccc(n1)C(F)(F)F)C(=O)C
InChI=1SC16H15F3N2O3c132414911(4513(14)23)812(10(2)22)217615(2021)16(1718)19h4923H3H212H3b128+
MFCD08557550
ZINC000020606088
ZINC20606088
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