Vitas-M small molecule compound

4-{(E)-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]methyl}phenyl benzoate

Catalog ID
STL570590
SMILES O=C(c1ccccc1)Oc1ccc(cc1)/C=N/c1c(=O)n(n(c1C)C)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 C25H21N3O3 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O3/c1-18-23(24(29)28(27(18)2)21-11-7-4-8-12-21)26-17-19-13-15-22(16-14-19)31-25(30)20-9-5-3-6-10-20/h3-17H,1-2H3/b26-17+
InChIKey
OFMJGBYDRDNFHT-YZSQISJMSA-N
Synonyms

4((E)((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)imino)methyl)phenylbenzoate
MFCD00737415
ZINC000000704512

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Available files

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