Vitas-M small molecule compound
(4E)-4-(3,5-dimethoxybenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL412333
SMILES COc1cc(cc(c1)OC)/C=C/1\C(=NN(C1=O)c1ccccc1)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 C18H16N2O4 MW 324.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O4/c1-23-14-8-12(9-15(11-14)24-2)10-16-17(21)19-20(18(16)22)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,19,21)/b16-10+InChIKey
DRSLCJJCFHISCX-MHWRWJLKSA-NSynonyms
(4E)4((35DIMETHOXYPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(35dimethoxybenzylidene)5hydroxy2phenyl24dihydro3Hpyrazol3one
COC1=CC(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC
COc1cc(cc(c1)OC)C=C1C(=NN(C1=O)c1ccccc1)O
InChI=1SC18H16N2O4c12314812(915(1114)242)101617(21)1920(18(16)22)136435713h311H12H3(H1921)b1610+
MFCD04086016
ZINC000006641179
ZINC06641179
ZINC6641179
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