2-[[ethyl-[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[2-(trifluoromethyl)-4-quinazolinyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C22H20F3N5O3 MolecularWeight: 459.42111

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C22H20F3N5O3/c1-4-30(19-12-7-5-6-8-14(12)27-21(29-19)22(23,24)25)11-18-26-15-10-17(33-3)16(32-2)9-13(15)20(31)28-18/h5-10H,4,11H2,1-3H3,(H,26,28,31)