Vitas-M small molecule compound

4-nitro-5-[(4-phenoxyphenyl)amino]benzene-1,2-dicarbonitrile

Catalog ID
STK269117
SMILES N#Cc1cc(Nc2ccc(cc2)Oc2ccccc2)c(cc1C#N)[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 C20H12N4O3 MW 356.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N4O3/c21-12-14-10-19(20(24(25)26)11-15(14)13-22)23-16-6-8-18(9-7-16)27-17-4-2-1-3-5-17/h1-11,23H
InChIKey
TWZHVGPTZWUYBM-UHFFFAOYSA-N
Synonyms

4nitro5((4phenoxyphenyl)amino)benzene12dicarbonitrile
4NITRO5(4PHENOXYANILINO)BENZENE12DICARBONITRILE
C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C(C=C(C(=C3)C#N)C#N)(N+)(=O)(O)
InChI=1SC20H12N4O3c2112141019(20(24(25)26)1115(14)1322)23166818(9716)27174213517h11123H
MFCD01825376
N#Cc1cc(Nc2ccc(cc2)Oc2ccccc2)c(cc1C#N)(N+)(=O)(O)
ZINC000004064585
ZINC04064585
ZINC4064585

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Available files

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