N-isoquinolin-5-yl-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-isoquinolin-5-yl-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-(5-isoquinolyl)-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-(5-isoquinolinyl)-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-isoquinolin-5-yl-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(5-isoquinolyl)-4-(4-ketoquinazolin-3-yl)butyramide Formula: C21H18N4O2 MolecularWeight: 358.39322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H18N4O2/c26-20(24-19-8-3-5-15-13-22-11-10-16(15)19)9-4-12-25-14-23-18-7-2-1-6-17(18)21(25)27/h1-3,5-8,10-11,13-14H,4,9,12H2,(H,24,26)