Vitas-M small molecule compound
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methyl-N-[4-(trifluoromethoxy)phenyl]acetamide
Catalog ID
STK770721
SMILES O=C(N(c1ccc(cc1)OC(F)(F)F)C)Cn1nc(c(c1C)Br)[N+](=O)[O-]
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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 C14H12BrF3N4O4 MW 437.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrF3N4O4/c1-8-12(15)13(22(24)25)19-21(8)7-11(23)20(2)9-3-5-10(6-4-9)26-14(16,17)18/h3-6H,7H2,1-2H3InChIKey
HFKHGZYXVQPCOU-UHFFFAOYSA-NSynonyms
2(4bromo5methyl3nitro1Hpyrazol1yl)NmethylN(4(trifluoromethoxy)phenyl)acetamide
2(4BROMO5METHYL3NITROPYRAZOL1YL)NMETHYLN(4(TRIFLUOROMETHOXY)PHENYL)ACETAMIDE
CC1=C(C(=NN1CC(=O)N(C)C2=CC=C(C=C2)OC(F)(F)F)(N+)(=O)(O))Br
InChI=1SC14H12BrF3N4O4c1812(15)13(22(24)25)1921(8)711(23)20(2)93510(649)2614(1617)18h36H7H212H3
MFCD03766532
O=C(N(c1ccc(cc1)OC(F)(F)F)C)Cn1nc(c(c1C)Br)(N+)(=O)(O)
ZINC000001073229
ZINC01073229
ZINC1073229
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