Vitas-M small molecule compound

2-(2,3-dimethylphenoxy)-N'-{(E)-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}acetohydrazide

Catalog ID
STK017643
SMILES O=C(COc1cccc(c1C)C)N/N=C/c1cccn1c1ccc(cc1)[N+](=O)[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 C21H20N4O4 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4/c1-15-5-3-7-20(16(15)2)29-14-21(26)23-22-13-19-6-4-12-24(19)17-8-10-18(11-9-17)25(27)28/h3-13H,14H2,1-2H3,(H,23,26)/b22-13+
InChIKey
ZCABXLWSDPSYLE-LPYMAVHISA-N
Synonyms

2(23DIMETHYLPHENOXY)N((E)(1(4NITROPHENYL)1HPYRROL2YL)METHYLIDENE)ACETOHYDRAZIDE
2(23DIMETHYLPHENOXY)N((E)(1(4NITROPHENYL)PYRROL2YL)METHYLIDENEAMINO)ACETAMIDE
CC1=C(C(=CC=C1)OCC(=O)NN=CC2=CC=CN2C3=CC=C(C=C3)(N+)(=O)(O))C
InChI=1SC21H20N4O4c11553720(16(15)2)291421(26)23221319641224(19)1781018(11917)25(27)28h313H14H212H3(H2326)b2213+
MFCD08049696
O=C(COc1cccc(c1C)C)NN=Cc1cccn1c1ccc(cc1)(N+)(=O)(O)
STK017643
ZINC000000989450
ZINC33288407

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Available files

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