Vitas-M small molecule compound

(4E)-5-hydroxy-4-[4-(morpholin-4-yl)-3-nitrobenzylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STL505598
SMILES OC1=NN(C(=O)/C/1=C/c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)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 C20H18N4O5 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O5/c25-19-16(20(26)23(21-19)15-4-2-1-3-5-15)12-14-6-7-17(18(13-14)24(27)28)22-8-10-29-11-9-22/h1-7,12-13H,8-11H2,(H,21,25)/b16-12+
InChIKey
ZRAAPPHPXACMFU-FOWTUZBSSA-N
Synonyms

(4~(E))4((4morpholin4yl3nitrophenyl)methylidene)1phenylpyrazolidine35dione
(4E)5hydroxy4(4(morpholin4yl)3nitrobenzylidene)2phenyl24dihydro3Hpyrazol3one
6511507
MFCD31538853

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Available files

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