Vitas-M small molecule compound
(4Z)-4-(4-ethylbenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL507528
SMILES CCc1ccc(cc1)/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 C18H16N2O2 MW 292.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O2/c1-2-13-8-10-14(11-9-13)12-16-17(21)19-20(18(16)22)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,19,21)/b16-12-InChIKey
IAHPLNHUKFXLIG-VBKFSLOCSA-NSynonyms
(4~(Z))4((4ethylphenyl)methylidene)1phenylpyrazolidine35dione
(4Z)4((4ETHYLPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4Z)4(4ethylbenzylidene)5hydroxy2phenyl24dihydro3Hpyrazol3one
877696
InChI=1SC18H16N2O2c121381014(11913)121617(21)1920(18(16)22)156435715h312H2H21H3(H1921)b1612
MFCD01836168
ZINC000000446836
ZINC446836
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