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

Systemtic Name: N-[4-[[[2-(dimethylamino)-7-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[[[2-(dimethylamino)-7-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[[[2-(dimethylamino)-7-methyl-4-quinazolinyl]amino]methyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[[[2-(dimethylamino)-7-methylquinazolin-4-yl]amino]methyl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[[[2-(dimethylamino)-7-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoro-benzamide Formula: C25H24FN5O MolecularWeight: 429.489363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N(C)C)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N(C)C)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H24FN5O/c1-16-4-13-21-22(14-16)29-25(31(2)3)30-23(21)27-15-17-5-11-20(12-6-17)28-24(32)18-7-9-19(26)10-8-18/h4-14H,15H2,1-3H3,(H,28,32)(H,27,29,30)