N-[4-[[[2-(azetidin-1-yl)-7-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[[[2-(azetidin-1-yl)-7-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[[[2-(azetidin-1-yl)-7-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[[[2-(1-azetidinyl)-7-methyl-4-quinazolinyl]amino]methyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[[[2-(azetidin-1-yl)-7-methylquinazolin-4-yl]amino]methyl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[[[2-(azetidin-1-yl)-7-methyl-quinazolin-4-yl]amino]methyl]phenyl]-4-fluoro-benzamide Formula: C26H24FN5O MolecularWeight: 441.500063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC3)NCC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC3)NCC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H24FN5O/c1-17-3-12-22-23(15-17)30-26(32-13-2-14-32)31-24(22)28-16-18-4-10-21(11-5-18)29-25(33)19-6-8-20(27)9-7-19/h3-12,15H,2,13-14,16H2,1H3,(H,29,33)(H,28,30,31)