Vitas-M small molecule compound
2-{3-[(E)-2-(4-methoxyphenyl)ethenyl]-5-(trifluoromethyl)-1H-pyrazol-1-yl}-1,3-thiazole-4-carboxylic acid
Catalog ID
STL439593
SMILES COc1ccc(cc1)/C=C/c1nn(c(c1)C(F)(F)F)c1scc(n1)C(=O)O
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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 C17H12F3N3O3S MW 395.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12F3N3O3S/c1-26-12-6-3-10(4-7-12)2-5-11-8-14(17(18,19)20)23(22-11)16-21-13(9-27-16)15(24)25/h2-9H,1H3,(H,24,25)/b5-2+InChIKey
VLKDHZMWNXTSEF-GORDUTHDSA-NSynonyms
2(3((E)2(4methoxyphenyl)ethenyl)5(trifluoromethyl)1Hpyrazol1yl)13thiazole4carboxylicacid
2(3((E)2(4methoxyphenyl)ethenyl)5(trifluoromethyl)pyrazol1yl)13thiazole4carboxylicacid
COC1=CC=C(C=C1)C=CC2=NN(C(=C2)C(F)(F)F)C3=NC(=CS3)C(=O)O
COc1ccc(cc1)C=Cc1nn(c(c1)C(F)(F)F)c1scc(n1)C(=O)O
InChI=1SC17H12F3N3O3Sc126126310(4712)2511814(17(1819)20)23(2211)162113(92716)15(24)25h29H1H3(H2425)b52+
MFCD30712081
ZINC000033458153
ZINC33458153
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