4-fluoranyl-N-[4-[[[7-methyl-2-(propylamino)quinazolin-4-yl]amino]methyl]phenyl]benzamide

Systemtic Name: 4-fluoranyl-N-[4-[[[7-methyl-2-(propylamino)quinazolin-4-yl]amino]methyl]phenyl]benzamide Openeye Name: 4-fluoro-N-[4-[[[7-methyl-2-(propylamino)quinazolin-4-yl]amino]methyl]phenyl]benzamide CAS Name: 4-fluoro-N-[4-[[[7-methyl-2-(propylamino)-4-quinazolinyl]amino]methyl]phenyl]benzamide IUPAC Name: 4-fluoro-N-[4-[[[7-methyl-2-(propylamino)quinazolin-4-yl]amino]methyl]phenyl]benzamide Traditional Name: 4-fluoro-N-[4-[[[7-methyl-2-(propylamino)quinazolin-4-yl]amino]methyl]phenyl]benzamide Formula: C26H26FN5O MolecularWeight: 443.515943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC2=C(C=CC(=C2)C)C(=N1)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCCNC1=NC2=C(C=CC(=C2)C)C(=N1)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H26FN5O/c1-3-14-28-26-31-23-15-17(2)4-13-22(23)24(32-26)29-16-18-5-11-21(12-6-18)30-25(33)19-7-9-20(27)10-8-19/h4-13,15H,3,14,16H2,1-2H3,(H,30,33)(H2,28,29,31,32)