Vitas-M small molecule compound
(4Z)-2-(3,4-dimethylphenyl)-4-(3-ethoxy-4-hydroxy-5-iodobenzylidene)-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL507671
SMILES CCOc1cc(/C=C\2/C(=NN(C2=O)c2ccc(c(c2)C)C)O)cc(c1O)I
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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 C20H19IN2O4 MW 478.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19IN2O4/c1-4-27-17-10-13(9-16(21)18(17)24)8-15-19(25)22-23(20(15)26)14-6-5-11(2)12(3)7-14/h5-10,24H,4H2,1-3H3,(H,22,25)/b15-8-InChIKey
LWKQEGVFWDIYMI-NVNXTCNLSA-NSynonyms
(4~(Z))1(34dimethylphenyl)4((3ethoxy4hydroxy5iodophenyl)methylidene)pyrazolidine35dione
(4Z)1(34DIMETHYLPHENYL)4((3ETHOXY4HYDROXY5IODOPHENYL)METHYLIDENE)PYRAZOLIDINE35DIONE
(4Z)2(34dimethylphenyl)4(3ethoxy4hydroxy5iodobenzylidene)5hydroxy24dihydro3Hpyrazol3one
1219046
InChI=1SC20H19IN2O4c1427171013(916(21)18(17)24)81519(25)2223(20(15)26)146511(2)12(3)714h51024H4H213H3(H2225)b158
MFCD31615378
ZINC000033288549
ZINC33288549
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