Vitas-M small molecule compound

methyl {[2-ethyl-4-(trifluoromethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]sulfanyl}acetate

Catalog ID
STK353013
SMILES COC(=O)CSc1nc2nn(cc2c(c1)C(F)(F)F)CC

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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 C12H12F3N3O2S MW 319.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12F3N3O2S/c1-3-18-5-7-8(12(13,14)15)4-9(16-11(7)17-18)21-6-10(19)20-2/h4-5H,3,6H2,1-2H3
InChIKey
RUYXYXHQZOBSBE-UHFFFAOYSA-N
Synonyms
1018047-30-7
1018047307
CCN1C=C2C(=CC(=NC2=N1)SCC(=O)OC)C(F)(F)F
InChI=1SC12H12F3N3O2Sc1318578(12(1314)15)49(1611(7)1718)21610(19)202h45H36H212H3
methyl((2ethyl4(trifluoromethyl)2Hpyrazolo(34b)pyridin6yl)sulfanyl)acetate
methyl2(2ethyl4(trifluoromethyl)pyrazolo(34b)pyridin6yl)sulfanylacetate
METHYL2(2ETHYL4(TRIFLUOROMETHYL)PYRAZOLO(43E)PYRIDIN6YLTHIO)ACETATE
MFCD09859293
ZINC000012398490
ZINC12398490

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Available files

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