Vitas-M small molecule compound
diethyl 5-({[3-bromo-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK342563
SMILES CCOC(=O)c1c(NC(=O)c2nn3c(c2Br)nc(cc3C(F)(F)F)c2ccccc2)sc(c1C)C(=O)OCC
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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 C25H20BrF3N4O5S MW 625.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrF3N4O5S/c1-4-37-23(35)16-12(3)19(24(36)38-5-2)39-22(16)31-21(34)18-17(26)20-30-14(13-9-7-6-8-10-13)11-15(25(27,28)29)33(20)32-18/h6-11H,4-5H2,1-3H3,(H,31,34)InChIKey
XRCMJPZPCPBDOU-UHFFFAOYSA-NSynonyms
304687-15-8304687158
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN3C(=CC(=NC3=C2Br)C4=CC=CC=C4)C(F)(F)F
DIETHYL5(((3BROMO5PHENYL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
diethyl5(((3bromo5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)3methylthiophene24dicarboxylate
DIETHYL5((3BROMO5PHENYL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC25H20BrF3N4O5Sc143723(35)1612(3)19(24(36)3852)3922(16)3121(34)1817(26)203014(1397681013)1115(25(2728)29)33(20)3218h611H45H213H3(H3134)
MFCD00291759
ZINC000008435453
ZINC08435453
ZINC8435453
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