Vitas-M small molecule compound
(4E)-4-(1,3-benzodioxol-5-ylmethylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL508290
SMILES OC1=NN(C(=O)/C/1=C/c1ccc2c(c1)OCO2)c1ccccc1
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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 C17H12N2O4 MW 308.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O4/c20-16-13(8-11-6-7-14-15(9-11)23-10-22-14)17(21)19(18-16)12-4-2-1-3-5-12/h1-9H,10H2,(H,18,20)/b13-8+InChIKey
ZAWWTLSEDJEYJA-MDWZMJQESA-NSynonyms
(4~(E))4(13benzodioxol5ylmethylidene)1phenylpyrazolidine35dione
(4E)4(13BENZODIOXOL5YLMETHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(13benzodioxol5ylmethylidene)5hydroxy2phenyl24dihydro3Hpyrazol3one
1718047
4BENZO(13)DIOXOL5YLMETHYLENE1PHENYLPYRAZOLIDINE35DIONE
InChI=1SC17H12N2O4c201613(811671415(911)23102214)17(21)19(1816)124213512h19H10H2(H1820)b138+
MFCD01241497
ZINC000005683758
ZINC5683758
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