4-methyl-N-(3-morpholin-4-ylpropyl)-3-[[4-[(4-phenylquinazolin-2-yl)amino]phenyl]carbonylamino]benzamide

Systemtic Name: 4-methyl-N-(3-morpholin-4-ylpropyl)-3-[[4-[(4-phenylquinazolin-2-yl)amino]phenyl]carbonylamino]benzamide Openeye Name: 4-methyl-N-(3-morpholinopropyl)-3-[[4-[(4-phenylquinazolin-2-yl)amino]benzoyl]amino]benzamide CAS Name: 4-methyl-N-[3-(4-morpholinyl)propyl]-3-[[oxo-[4-[(4-phenyl-2-quinazolinyl)amino]phenyl]methyl]amino]benzamide IUPAC Name: 4-methyl-N-(3-morpholin-4-ylpropyl)-3-[[4-[(4-phenylquinazolin-2-yl)amino]benzoyl]amino]benzamide Traditional Name: 4-methyl-N-(3-morpholinopropyl)-3-[[4-[(4-phenylquinazolin-2-yl)amino]benzoyl]amino]benzamide Formula: C36H36N6O3 MolecularWeight: 600.70944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCN2CCOCC2)NC(=O)C3=CC=C(C=C3)NC4=NC5=CC=CC=C5C(=N4)C6=CC=CC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCN2CCOCC2)NC(=O)C3=CC=C(C=C3)NC4=NC5=CC=CC=C5C(=N4)C6=CC=CC=C6

InChI

InChI=1S/C36H36N6O3/c1-25-12-13-28(34(43)37-18-7-19-42-20-22-45-23-21-42)24-32(25)39-35(44)27-14-16-29(17-15-27)38-36-40-31-11-6-5-10-30(31)33(41-36)26-8-3-2-4-9-26/h2-6,8-17,24H,7,18-23H2,1H3,(H,37,43)(H,39,44)(H,38,40,41)