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

Systemtic Name: 2-[[ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]amino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Formula: C21H18F3N5O2 MolecularWeight: 429.39513

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(F)(F)F

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N5O2/c1-2-29(10-17-25-15-6-4-3-5-13(15)19(30)27-17)11-18-26-16-9-12(21(22,23)24)7-8-14(16)20(31)28-18/h3-9H,2,10-11H2,1H3,(H,25,27,30)(H,26,28,31)