3-(2-azanylquinazolin-6-yl)-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(2-azanylquinazolin-6-yl)-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(2-aminoquinazolin-6-yl)-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: 3-(2-amino-6-quinazolinyl)-N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(2-aminoquinazolin-6-yl)-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(2-aminoquinazolin-6-yl)-N-[2-(4-methylpiperazino)-5-(trifluoromethyl)phenyl]benzamide Formula: C27H25F3N6O MolecularWeight: 506.52221

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=CC(=C3)C4=CC5=CN=C(N=C5C=C4)N

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=CC(=C3)C4=CC5=CN=C(N=C5C=C4)N

InChI

InChI=1S/C27H25F3N6O/c1-35-9-11-36(12-10-35)24-8-6-21(27(28,29)30)15-23(24)33-25(37)19-4-2-3-17(13-19)18-5-7-22-20(14-18)16-32-26(31)34-22/h2-8,13-16H,9-12H2,1H3,(H,33,37)(H2,31,32,34)