5-(2-azanylquinazolin-6-yl)-2-fluoranyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 5-(2-azanylquinazolin-6-yl)-2-fluoranyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 5-(2-aminoquinazolin-6-yl)-2-fluoro-N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: 5-(2-amino-6-quinazolinyl)-2-fluoro-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 5-(2-aminoquinazolin-6-yl)-2-fluoro-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 5-(2-aminoquinazolin-6-yl)-2-fluoro-N-[2-piperidino-5-(trifluoromethyl)phenyl]benzamide Formula: C27H23F4N5O MolecularWeight: 509.498033

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=C(C=CC(=C3)C4=CC5=CN=C(N=C5C=C4)N)F

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=C(C=CC(=C3)C4=CC5=CN=C(N=C5C=C4)N)F

InChI

InChI=1S/C27H23F4N5O/c28-21-7-4-17(16-5-8-22-18(12-16)15-33-26(32)35-22)13-20(21)25(37)34-23-14-19(27(29,30)31)6-9-24(23)36-10-2-1-3-11-36/h4-9,12-15H,1-3,10-11H2,(H,34,37)(H2,32,33,35)