4'-[(6-Bromo-4-oxo-3(4H)-quinazolinyl)methyl]-2-biphenylcarbonitrile

ChemSpider ID: 22115277
Molecular Formula: C₂₂H₁₄BrN₃O
Average mass: 416.270111 Da
Monoisotopic mass: 415.032013 Da
Systematic name

4'-[(6-Bromo-4-oxo-3(4H)-quinazolinyl)methyl]-2-biphenylcarbonitrile
SMILES and InChIs

SMILES:

c1ccc(c(c1)C#N)c2ccc(cc2)Cn3cnc4ccc(cc4c3=O)Br Copied

Std. InChI:

InChI=1S/C22H14BrN3O/c23-18-9-10-21-20(11-18)22(27)26(14-25-21)13-15-5-7-16(8-6-15)19-4-2-1-3-17(19)12-24/h1-11,14H,13H2 Copied

Std. InChIKey:

WTSUFNNJYGSXCN-UHFFFAOYSA-N Copied
Cite this record
CSID:22115277, http://www.chemspider.com/Chemical-Structure.22115277.html (accessed 06:02, May 25, 2012) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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