Vitas-M small molecule compound
4,4'-({3,5-dibromo-4-[(2-chlorobenzyl)oxy]phenyl}methanediyl)bis(3-methyl-1H-pyrazol-5-ol)
Catalog ID
STK056460
SMILES Brc1cc(cc(c1OCc1ccccc1Cl)Br)C(c1c(O)[nH]nc1C)c1c(O)[nH]nc1C
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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 C22H19Br2ClN4O3 MW 582.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Br2ClN4O3/c1-10-17(21(30)28-26-10)19(18-11(2)27-29-22(18)31)13-7-14(23)20(15(24)8-13)32-9-12-5-3-4-6-16(12)25/h3-8,19H,9H2,1-2H3,(H2,26,28,30)(H2,27,29,31)InChIKey
ORAOIJTVZFXSPM-UHFFFAOYSA-NSynonyms
4((35DIBROMO4((2CHLOROPHENYL)METHOXY)PHENYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((35DIBROMO4((2CHLOROBENZYL)OXY)PHENYL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
Brc1cc(cc(c1OCc1ccccc1Cl)Br)C(c1c(O)(nH)nc1C)c1c(O)(nH)nc1C
CC1=C(C(=O)NN1)C(C2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3Cl)Br)C4=C(NNC4=O)C
InChI=1SC22H19Br2ClN4O3c11017(21(30)282610)19(1811(2)272922(18)31)13714(23)20(15(24)813)32912534616(12)25h3819H9H212H3(H2262830)(H2272931)
MFCD03272426
STK056460
ZINC000098045021
ZINC98045021
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