3-[2-(4-oxidanylidene-2-pyridin-4-yl-6H-pyrimido[2,1-b]quinazolin-11-yl)ethanoyl]benzenecarbonitrile

Systemtic Name: 3-[2-(4-oxidanylidene-2-pyridin-4-yl-6H-pyrimido[2,1-b]quinazolin-11-yl)ethanoyl]benzenecarbonitrile Openeye Name: 3-[2-[4-oxo-2-(4-pyridyl)-6H-pyrimido[2,1-b]quinazolin-11-yl]acetyl]benzonitrile CAS Name: 3-[1-oxo-2-(4-oxo-2-pyridin-4-yl-6H-pyrimido[2,1-b]quinazolin-11-yl)ethyl]benzonitrile IUPAC Name: 3-[2-(4-oxo-2-pyridin-4-yl-6H-pyrimido[2,1-b]quinazolin-11-yl)acetyl]benzonitrile Traditional Name: 3-[2-[4-keto-2-(4-pyridyl)-6H-pyrimido[2,1-b]quinazolin-11-yl]acetyl]benzonitrile Formula: C25H17N5O2 MolecularWeight: 419.43478

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N(C3=NC(=CC(=O)N31)C4=CC=NC=C4)CC(=O)C5=CC=CC(=C5)C#N

Isomeric SMILES

C1C2=CC=CC=C2N(C3=NC(=CC(=O)N31)C4=CC=NC=C4)CC(=O)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C25H17N5O2/c26-14-17-4-3-6-19(12-17)23(31)16-29-22-7-2-1-5-20(22)15-30-24(32)13-21(28-25(29)30)18-8-10-27-11-9-18/h1-13H,15-16H2