Vitas-M small molecule compound
2-[(2E)-2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxybenzylidene}hydrazinyl]benzoic acid
Catalog ID
STK061072
SMILES COc1ccc(cc1Cn1nc(c(c1C)Br)C)/C=N/Nc1ccccc1C(=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 C21H21BrN4O3 MW 457.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN4O3/c1-13-20(22)14(2)26(25-13)12-16-10-15(8-9-19(16)29-3)11-23-24-18-7-5-4-6-17(18)21(27)28/h4-11,24H,12H2,1-3H3,(H,27,28)/b23-11+InChIKey
IKVZJWDWAKRKGV-FOKLQQMPSA-NSynonyms
304654-14-6(E)2(2(3((4bromo35dimethyl1Hpyrazol1yl)methyl)4methoxybenzylidene)hydrazinyl)benzoicacid
2((2E)2((3((4bromo35dimethylpyrazol1yl)methyl)4methoxyphenyl)methylidene)hydrazinyl)benzoicacid
2((2E)2(3((4BROMO35DIMETHYL1HPYRAZOL1YL)METHYL)4METHOXYBENZYLIDENE)HYDRAZINYL)BENZOICACID
304654146
CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC3=CC=CC=C3C(=O)O)OC)C)Br
COc1ccc(cc1Cn1nc(c(c1C)Br)C)C=NNc1ccccc1C(=O)O
InChI=1SC21H21BrN4O3c11320(22)14(2)26(2513)12161015(8919(16)293)11232418754617(18)21(27)28h41124H12H213H3(H2728)b2311+
MFCD01559802
STK061072
ZINC000013756112
ZINC59810658
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