Vitas-M small molecule compound
ethyl 2-({[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK838072
SMILES CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)C(F)(F)F)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 C16H17BrF3N3O3S MW 468.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrF3N3O3S/c1-5-26-15(25)11-7(2)9(4)27-14(11)21-10(24)6-23-8(3)12(17)13(22-23)16(18,19)20/h5-6H2,1-4H3,(H,21,24)InChIKey
ZZVXDWQJNCCJBG-UHFFFAOYSA-NSynonyms
355805-41-3355805413
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C(=C(C(=N2)C(F)(F)F)Br)C
ETHYL2(((4BROMO5METHYL3(TRIFLUOROMETHYL)1HPYRAZOL1YL)ACETYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLATE
ethyl2(((4bromo5methyl3(trifluoromethyl)1Hpyrazol1yl)acetyl)amino)45dimethylthiophene3carboxylate
ETHYL2((2(4BROMO5METHYL3(TRIFLUOROMETHYL)PYRAZOL1YL)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ethyl2(2(4bromo5methyl3(trifluoromethyl)1Hpyrazol1yl)acetamido)45dimethylthiophene3carboxylate
InChI=1SC16H17BrF3N3O3Sc152615(25)117(2)9(4)2714(11)2110(24)6238(3)12(17)13(2223)16(1819)20h56H214H3(H2124)
MFCD01451910
ZINC000000997571
ZINC00997571
ZINC997571
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