Vitas-M small molecule compound

ethyl 4-({(E)-[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}amino)benzoate

Catalog ID
STK196796
SMILES CCOC(=O)c1ccc(cc1)/N=C/c1cc(n(c1C)c1cccc(c1)[N+](=O)[O-])C

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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 C22H21N3O4 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4/c1-4-29-22(26)17-8-10-19(11-9-17)23-14-18-12-15(2)24(16(18)3)20-6-5-7-21(13-20)25(27)28/h5-14H,4H2,1-3H3/b23-14+
InChIKey
MHSYLNCRDBUSBR-OEAKJJBVSA-N
Synonyms
348594-82-1
348594821
CCOC(=O)c1ccc(cc1)N=Cc1cc(n(c1C)c1cccc(c1)(N+)(=O)(O))C
ethyl4(((E)(25dimethyl1(3nitrophenyl)1Hpyrrol3yl)methylidene)amino)benzoate
MFCD01541306
ZINC000004738834

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Available files

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