Vitas-M small molecule compound
4,4'-({2-[(4-bromobenzyl)oxy]phenyl}methanediyl)bis(3-methyl-1H-pyrazol-5-ol)
Catalog ID
STK067976
SMILES Brc1ccc(cc1)COc1ccccc1C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O
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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 C22H21BrN4O3 MW 469.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN4O3/c1-12-18(21(28)26-24-12)20(19-13(2)25-27-22(19)29)16-5-3-4-6-17(16)30-11-14-7-9-15(23)10-8-14/h3-10,20H,11H2,1-2H3,(H2,24,26,28)(H2,25,27,29)InChIKey
CCBVNKWSKKLHEF-UHFFFAOYSA-NSynonyms
4((2((4BROMOPHENYL)METHOXY)PHENYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((2((4BROMOBENZYL)OXY)PHENYL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
Brc1ccc(cc1)COc1ccccc1C(c1c(C)n(nH)c1O)c1c(C)n(nH)c1O
CC1=C(C(=O)NN1)C(C2=CC=CC=C2OCC3=CC=C(C=C3)Br)C4=C(NNC4=O)C
InChI=1SC22H21BrN4O3c11218(21(28)262412)20(1913(2)252722(19)29)16534617(16)3011147915(23)10814h31020H11H212H3(H2242628)(H2252729)
MFCD03447988
STK067976
ZINC000020119960
ZINC20119960
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