Vitas-M small molecule compound
methyl 2-({[3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK957390
SMILES COC(=O)c1c(NC(=O)c2nn3c(c2Br)nc(cc3C(F)(F)F)c2cccs2)sc(c1C)C
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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 C20H14BrF3N4O3S2 MW 559.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrF3N4O3S2/c1-8-9(2)33-18(13(8)19(30)31-3)26-17(29)15-14(21)16-25-10(11-5-4-6-32-11)7-12(20(22,23)24)28(16)27-15/h4-7H,1-3H3,(H,26,29)InChIKey
GMTSFDMSQLEDTR-UHFFFAOYSA-NSynonyms
352681-29-9352681299
CC1=C(SC(=C1C(=O)OC)NC(=O)C2=NN3C(=CC(=NC3=C2Br)C4=CC=CS4)C(F)(F)F)C
InChI=1SC20H14BrF3N4O3S2c189(2)3318(13(8)19(30)313)2617(29)1514(21)162510(115463211)712(20(2223)24)28(16)2715h47H13H3(H2629)
METHYL2(((3BROMO5(2THIENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLATE
methyl2(((3bromo5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)45dimethylthiophene3carboxylate
METHYL2(((3BROMO5THIEN2YL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2((3BROMO5THIOPHEN2YL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBONYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD01919069
ZINC000000996171
ZINC00996171
ZINC996171
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.