2-[[(4-oxidanylidenequinazolin-3-yl)amino]methylidene]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[(4-oxidanylidenequinazolin-3-yl)amino]methylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[[(4-oxoquinazolin-3-yl)amino]methylene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[[(4-oxo-3-quinazolinyl)amino]methylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[[(4-oxoquinazolin-3-yl)amino]methylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[[(4-ketoquinazolin-3-yl)amino]methylene]-5-phenyl-cyclohexane-1,3-quinone Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(=CNN2C=NC3=CC=CC=C3C2=O)C1=O)C4=CC=CC=C4

Isomeric SMILES

C1C(CC(=O)C(=CNN2C=NC3=CC=CC=C3C2=O)C1=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O3/c25-19-10-15(14-6-2-1-3-7-14)11-20(26)17(19)12-23-24-13-22-18-9-5-4-8-16(18)21(24)27/h1-9,12-13,15,23H,10-11H2