N-(2,6-dimethylphenyl)-4-[[7-(3-morpholin-4-ylpropoxy)-4-phenyl-quinazolin-2-yl]amino]benzamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[[7-(3-morpholin-4-ylpropoxy)-4-phenyl-quinazolin-2-yl]amino]benzamide Openeye Name: N-(2,6-dimethylphenyl)-4-[[7-(3-morpholinopropoxy)-4-phenyl-quinazolin-2-yl]amino]benzamide CAS Name: N-(2,6-dimethylphenyl)-4-[[7-[3-(4-morpholinyl)propoxy]-4-phenyl-2-quinazolinyl]amino]benzamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[[7-(3-morpholin-4-ylpropoxy)-4-phenylquinazolin-2-yl]amino]benzamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[7-(3-morpholinopropoxy)-4-phenyl-quinazolin-2-yl]amino]benzamide Formula: C36H37N5O3 MolecularWeight: 587.71068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)NC3=NC4=C(C=CC(=C4)OCCCN5CCOCC5)C(=N3)C6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)NC3=NC4=C(C=CC(=C4)OCCCN5CCOCC5)C(=N3)C6=CC=CC=C6

InChI

InChI=1S/C36H37N5O3/c1-25-8-6-9-26(2)33(25)39-35(42)28-12-14-29(15-13-28)37-36-38-32-24-30(44-21-7-18-41-19-22-43-23-20-41)16-17-31(32)34(40-36)27-10-4-3-5-11-27/h3-6,8-17,24H,7,18-23H2,1-2H3,(H,39,42)(H,37,38,40)