[4-[[4-[3-(dimethylamino)propylamino]quinazolin-2-yl]methyl]piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-[[4-[3-(dimethylamino)propylamino]quinazolin-2-yl]methyl]piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone Openeye Name: [4-[[4-[3-(dimethylamino)propylamino]quinazolin-2-yl]methyl]piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone CAS Name: [4-[[4-[3-(dimethylamino)propylamino]-2-quinazolinyl]methyl]-1-piperazinyl]-[2-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-[[4-[3-(dimethylamino)propylamino]quinazolin-2-yl]methyl]piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone Traditional Name: [4-[[4-[3-(dimethylamino)propylamino]quinazolin-2-yl]methyl]piperazino]-[2-(trifluoromethyl)phenyl]methanone Formula: C26H31F3N6O MolecularWeight: 500.55915

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=NC(=NC2=CC=CC=C21)CN3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CN(C)CCCNC1=NC(=NC2=CC=CC=C21)CN3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C26H31F3N6O/c1-33(2)13-7-12-30-24-20-9-4-6-11-22(20)31-23(32-24)18-34-14-16-35(17-15-34)25(36)19-8-3-5-10-21(19)26(27,28)29/h3-6,8-11H,7,12-18H2,1-2H3,(H,30,31,32)