Vitas-M small molecule compound
(4Z)-4-(2,3-dibromo-4-hydroxy-5-methoxybenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK742514
SMILES COc1cc(/C=C\2/C(=NN(C2=O)c2ccccc2)O)c(c(c1O)Br)Br
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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 C17H12Br2N2O4 MW 468.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12Br2N2O4/c1-25-12-8-9(13(18)14(19)15(12)22)7-11-16(23)20-21(17(11)24)10-5-3-2-4-6-10/h2-8,22H,1H3,(H,20,23)/b11-7-InChIKey
VYSRSBVGMXHZRH-XFFZJAGNSA-NSynonyms
(4Z)4((23DIBROMO4HYDROXY5METHOXYPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4Z)4(23dibromo4hydroxy5methoxybenzylidene)5hydroxy2phenyl24dihydro3Hpyrazol3one
(E)4(23dibromo4hydroxy5methoxybenzylidene)3hydroxy1phenyl1Hpyrazol5(4H)one
COC1=C(C(=C(C(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)Br)O
COc1cc(C=C2C(=NN(C2=O)c2ccccc2)O)c(c(c1O)Br)Br
InChI=1SC17H12Br2N2O4c1251289(13(18)14(19)15(12)22)71116(23)2021(17(11)24)105324610h2822H1H3(H2023)b117
MFCD03167056
ZINC000033351013
ZINC33351013
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