N-[4-[[[2-(diethylamino)-6-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[[[2-(diethylamino)-6-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[[[2-(diethylamino)-6-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[[[2-(diethylamino)-6-methyl-4-quinazolinyl]amino]methyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[[[2-(diethylamino)-6-methylquinazolin-4-yl]amino]methyl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[[[2-(diethylamino)-6-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoro-benzamide Formula: C27H28FN5O MolecularWeight: 457.542523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC2=C(C=C(C=C2)C)C(=N1)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCN(CC)C1=NC2=C(C=C(C=C2)C)C(=N1)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H28FN5O/c1-4-33(5-2)27-31-24-15-6-18(3)16-23(24)25(32-27)29-17-19-7-13-22(14-8-19)30-26(34)20-9-11-21(28)12-10-20/h6-16H,4-5,17H2,1-3H3,(H,30,34)(H,29,31,32)