Vitas-M small molecule compound

methyl 2-[4-(ethoxycarbonyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate

Catalog ID
STL441822
SMILES CCOC(=O)c1cnn(c1C(F)(F)F)c1scc(n1)C(=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 C12H10F3N3O4S MW 349.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10F3N3O4S/c1-3-22-9(19)6-4-16-18(8(6)12(13,14)15)11-17-7(5-23-11)10(20)21-2/h4-5H,3H2,1-2H3
InChIKey
RIYRAVDMALBDTD-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C(=O)OC)C(F)(F)F
InChI=1SC12H10F3N3O4Sc13229(19)641618(8(6)12(1314)15)11177(52311)10(20)212h45H3H212H3
methyl2(4(ethoxycarbonyl)5(trifluoromethyl)1Hpyrazol1yl)13thiazole4carboxylate
methyl2(4ethoxycarbonyl5(trifluoromethyl)pyrazol1yl)13thiazole4carboxylate
MFCD09992517
ZINC000025185814
ZINC25185814

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.