Vitas-M small molecule compound

(4Z)-4-(3-chloro-4,5-diethoxybenzylidene)-5-hydroxy-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STL507721
SMILES CCOc1cc(/C=C\2/C(=NN(C2=O)c2ccc(cc2)C)O)cc(c1OCC)Cl

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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 C21H21ClN2O4 MW 400.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O4/c1-4-27-18-12-14(11-17(22)19(18)28-5-2)10-16-20(25)23-24(21(16)26)15-8-6-13(3)7-9-15/h6-12H,4-5H2,1-3H3,(H,23,25)/b16-10-
InChIKey
FGDQZTGBGRDDSD-YBEGLDIGSA-N
Synonyms

(4~(Z))4((3chloro45diethoxyphenyl)methylidene)1(4methylphenyl)pyrazolidine35dione
(4Z)4(3chloro45diethoxybenzylidene)5hydroxy2(4methylphenyl)24dihydro3Hpyrazol3one
1336034
MFCD31615427

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.