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

Systemtic Name: 4-fluoranyl-N-[4-[[(7-methyl-2-pyrrolidin-1-yl-quinazolin-4-yl)amino]methyl]phenyl]benzamide Openeye Name: 4-fluoro-N-[4-[[(7-methyl-2-pyrrolidin-1-yl-quinazolin-4-yl)amino]methyl]phenyl]benzamide CAS Name: 4-fluoro-N-[4-[[[7-methyl-2-(1-pyrrolidinyl)-4-quinazolinyl]amino]methyl]phenyl]benzamide IUPAC Name: 4-fluoro-N-[4-[[(7-methyl-2-pyrrolidin-1-ylquinazolin-4-yl)amino]methyl]phenyl]benzamide Traditional Name: 4-fluoro-N-[4-[[(7-methyl-2-pyrrolidino-quinazolin-4-yl)amino]methyl]phenyl]benzamide Formula: C27H26FN5O MolecularWeight: 455.526643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC3)NCC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC3)NCC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H26FN5O/c1-18-4-13-23-24(16-18)31-27(33-14-2-3-15-33)32-25(23)29-17-19-5-11-22(12-6-19)30-26(34)20-7-9-21(28)10-8-20/h4-13,16H,2-3,14-15,17H2,1H3,(H,30,34)(H,29,31,32)