5-(2-azanylquinazolin-6-yl)-2-fluoranyl-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 5-(2-azanylquinazolin-6-yl)-2-fluoranyl-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 5-(2-aminoquinazolin-6-yl)-2-fluoro-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 5-(2-amino-6-quinazolinyl)-2-fluoro-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 5-(2-aminoquinazolin-6-yl)-2-fluoro-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 5-(2-aminoquinazolin-6-yl)-2-fluoro-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C23H16F4N4O MolecularWeight: 440.392953

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CC3=CN=C(N=C3C=C2)N)C(=O)NC4=CC=CC(=C4)C(F)(F)F)F

Isomeric SMILES

CC1=CC(=C(C=C1C2=CC3=CN=C(N=C3C=C2)N)C(=O)NC4=CC=CC(=C4)C(F)(F)F)F

InChI

InChI=1S/C23H16F4N4O/c1-12-7-19(24)18(21(32)30-16-4-2-3-15(9-16)23(25,26)27)10-17(12)13-5-6-20-14(8-13)11-29-22(28)31-20/h2-11H,1H3,(H,30,32)(H2,28,29,31)