(2E,4E)-2-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-5-(2-methoxyphenyl)penta-2,4-dienenitrile

Systemtic Name: (2E,4E)-2-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-5-(2-methoxyphenyl)penta-2,4-dienenitrile Openeye Name: (2E,4E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-5-(2-methoxyphenyl)penta-2,4-dienenitrile CAS Name: (2E,4E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-5-(2-methoxyphenyl)penta-2,4-dienenitrile IUPAC Name: (2E,4E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-5-(2-methoxyphenyl)penta-2,4-dienenitrile Traditional Name: (2E,4E)-2-(6-bromo-4-keto-1H-quinazolin-2-yl)-5-(2-methoxyphenyl)penta-2,4-dienenitrile Formula: C20H14BrN3O2 MolecularWeight: 408.24806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC=C(C#N)C2=NC(=O)C3=C(N2)C=CC(=C3)Br

Isomeric SMILES

COC1=CC=CC=C1/C=C/C=C(\C#N)/C2=NC(=O)C3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C20H14BrN3O2/c1-26-18-8-3-2-5-13(18)6-4-7-14(12-22)19-23-17-10-9-15(21)11-16(17)20(25)24-19/h2-11H,1H3,(H,23,24,25)/b6-4+,14-7+