Vitas-M small molecule compound
3-{2-[5-phenyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl acetate
Catalog ID
STL446544
SMILES CC(=O)Oc1cccc(c1)c1csc(n1)n1nc(cc1c1ccccc1)C(F)(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 C21H14F3N3O2S MW 429.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14F3N3O2S/c1-13(28)29-16-9-5-8-15(10-16)17-12-30-20(25-17)27-18(14-6-3-2-4-7-14)11-19(26-27)21(22,23)24/h2-12H,1H3InChIKey
XYHZLGQDJQSASG-UHFFFAOYSA-NSynonyms
(3(2(5phenyl3(trifluoromethyl)pyrazol1yl)13thiazol4yl)phenyl)acetate
3(2(5phenyl3(trifluoromethyl)1Hpyrazol1yl)13thiazol4yl)phenylacetate
CC(=O)OC1=CC=CC(=C1)C2=CSC(=N2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CC=C4
InChI=1SC21H14F3N3O2Sc113(28)291695815(1016)17123020(2517)2718(146324714)1119(2627)21(2223)24h212H1H3
MFCD09992235
ZINC000033429186
ZINC33429186
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