2-[[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-bromanyl-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-bromanyl-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[2-bromo-4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[2-bromo-4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-bromo-4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[2-bromo-4-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]phenoxy]methyl]benzonitrile Formula: C23H15BrN4O3 MolecularWeight: 475.2942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)C=NN3C(=O)C4=CC=CC=C4NC3=O)Br)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)C=NN3C(=O)C4=CC=CC=C4NC3=O)Br)C#N

InChI

InChI=1S/C23H15BrN4O3/c24-19-11-15(9-10-21(19)31-14-17-6-2-1-5-16(17)12-25)13-26-28-22(29)18-7-3-4-8-20(18)27-23(28)30/h1-11,13H,14H2,(H,27,30)