4-cyano-N-[3-[(6,7-dimethoxyquinazolin-2-yl)amino]phenyl]benzamide hydrochloride

Systemtic Name: 4-cyano-N-[3-[(6,7-dimethoxyquinazolin-2-yl)amino]phenyl]benzamide hydrochloride Openeye Name: 4-cyano-N-[3-[(6,7-dimethoxyquinazolin-2-yl)amino]phenyl]benzamide hydrochloride CAS Name: 4-cyano-N-[3-[(6,7-dimethoxy-2-quinazolinyl)amino]phenyl]benzamide hydrochloride IUPAC Name: 4-cyano-N-[3-[(6,7-dimethoxyquinazolin-2-yl)amino]phenyl]benzamide hydrochloride Traditional Name: 4-cyano-N-[3-[(6,7-dimethoxyquinazolin-2-yl)amino]phenyl]benzamide hydrochloride Formula: C24H20ClN5O3 MolecularWeight: 461.9003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=NC(=N2)NC3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)C#N)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C=NC(=N2)NC3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)C#N)OC.Cl

InChI

InChI=1S/C24H19N5O3.ClH/c1-31-21-10-17-14-26-24(29-20(17)12-22(21)32-2)28-19-5-3-4-18(11-19)27-23(30)16-8-6-15(13-25)7-9-16;/h3-12,14H,1-2H3,(H,27,30)(H,26,28,29);1H