3-(4-oxidanylidenequinazolin-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide

Systemtic Name: 3-(4-oxidanylidenequinazolin-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide Openeye Name: 3-(4-oxoquinazolin-3-yl)-N-[5-(1-piperidyl)-8-isoquinolyl]propanamide CAS Name: 3-(4-oxo-3-quinazolinyl)-N-[5-(1-piperidinyl)-8-isoquinolinyl]propanamide IUPAC Name: 3-(4-oxoquinazolin-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide Traditional Name: 3-(4-ketoquinazolin-3-yl)-N-(5-piperidino-8-isoquinolyl)propionamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C25H25N5O2/c31-24(11-15-30-17-27-21-7-3-2-6-19(21)25(30)32)28-22-8-9-23(29-13-4-1-5-14-29)18-10-12-26-16-20(18)22/h2-3,6-10,12,16-17H,1,4-5,11,13-15H2,(H,28,31)