Vitas-M small molecule compound
methyl 2-{3-[2-(methoxycarbonyl)phenyl]-5-(trifluoromethyl)-1H-pyrazol-1-yl}-1,3-thiazole-4-carboxylate
Catalog ID
STL441759
SMILES COC(=O)c1csc(n1)n1nc(cc1C(F)(F)F)c1ccccc1C(=O)OC
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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 C17H12F3N3O4S MW 411.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12F3N3O4S/c1-26-14(24)10-6-4-3-5-9(10)11-7-13(17(18,19)20)23(22-11)16-21-12(8-28-16)15(25)27-2/h3-8H,1-2H3InChIKey
JMLXFQCIXOSYTQ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1C2=NN(C(=C2)C(F)(F)F)C3=NC(=CS3)C(=O)OC
InChI=1SC17H12F3N3O4Sc12614(24)1064359(10)11713(17(1819)20)23(2211)162112(82816)15(25)272h38H12H3
methyl2(3(2(methoxycarbonyl)phenyl)5(trifluoromethyl)1Hpyrazol1yl)13thiazole4carboxylate
methyl2(3(2methoxycarbonylphenyl)5(trifluoromethyl)pyrazol1yl)13thiazole4carboxylate
MFCD07774034
ZINC000005274854
ZINC5274854
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