N-[4-[[(2-chloranylquinazolin-4-yl)amino]methyl]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[[(2-chloranylquinazolin-4-yl)amino]methyl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[[(2-chloroquinazolin-4-yl)amino]methyl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[[(2-chloro-4-quinazolinyl)amino]methyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[[(2-chloroquinazolin-4-yl)amino]methyl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[[(2-chloroquinazolin-4-yl)amino]methyl]phenyl]-4-fluoro-benzamide Formula: C22H16ClFN4O MolecularWeight: 406.840043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)Cl)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)Cl)NCC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H16ClFN4O/c23-22-27-19-4-2-1-3-18(19)20(28-22)25-13-14-5-11-17(12-6-14)26-21(29)15-7-9-16(24)10-8-15/h1-12H,13H2,(H,26,29)(H,25,27,28)