2-chloranyl-6-fluoranyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]benzamide

Systemtic Name: 2-chloranyl-6-fluoranyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]benzamide Openeye Name: 2-chloro-6-fluoro-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]benzamide CAS Name: 2-chloro-6-fluoro-N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]benzamide IUPAC Name: 2-chloro-6-fluoro-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]benzamide Traditional Name: 2-chloro-6-fluoro-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]benzamide Formula: C25H22ClFN4O MolecularWeight: 448.919783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C25H22ClFN4O/c26-19-12-6-13-20(27)23(19)25(32)29-16-22-30-21-14-5-4-11-18(21)24(31-22)28-15-7-10-17-8-2-1-3-9-17/h1-6,8-9,11-14H,7,10,15-16H2,(H,29,32)(H,28,30,31)