Vitas-M small molecule compound

methyl 3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate

Catalog ID
STK329631
SMILES COC(=O)c1nn2c(c1Br)nc(cc2C(F)(F)F)c1cccs1

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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 C13H7BrF3N3O2S MW 406.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7BrF3N3O2S/c1-22-12(21)10-9(14)11-18-6(7-3-2-4-23-7)5-8(13(15,16)17)20(11)19-10/h2-5H,1H3
InChIKey
UECFGEMYWJQACO-UHFFFAOYSA-N
Synonyms

COC(=O)C1=NN2C(=CC(=NC2=C1Br)C3=CC=CS3)C(F)(F)F
InChI=1SC13H7BrF3N3O2Sc12212(21)109(14)11186(7324237)58(13(1516)17)20(11)1910h25H1H3
methyl3bromo5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxylate
METHYL3BROMO5THIOPHEN2YL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBOXYLATE
MFCD00981724
ZINC000000827045
ZINC00827045
ZINC827045

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Available files

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