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

Systemtic Name: 3-(2-azanylquinazolin-6-yl)-4-methyl-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(2-aminoquinazolin-6-yl)-4-methyl-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: 3-(2-amino-6-quinazolinyl)-4-methyl-N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(2-aminoquinazolin-6-yl)-4-methyl-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(2-aminoquinazolin-6-yl)-4-methyl-N-[2-(4-methylpiperazino)-5-(trifluoromethyl)phenyl]benzamide Formula: C28H27F3N6O MolecularWeight: 520.54879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCN(CC3)C)C4=CC5=CN=C(N=C5C=C4)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCN(CC3)C)C4=CC5=CN=C(N=C5C=C4)N

InChI

InChI=1S/C28H27F3N6O/c1-17-3-4-19(14-22(17)18-5-7-23-20(13-18)16-33-27(32)35-23)26(38)34-24-15-21(28(29,30)31)6-8-25(24)37-11-9-36(2)10-12-37/h3-8,13-16H,9-12H2,1-2H3,(H,34,38)(H2,32,33,35)