4-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide

Systemtic Name: 4-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Openeye Name: 4-(4-oxo-1H-quinazolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide CAS Name: 4-(4-oxo-1H-quinazolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide IUPAC Name: 4-(4-oxo-1H-quinazolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Traditional Name: 4-(4-keto-1H-quinazolin-2-yl)-N-[3-(trifluoromethyl)benzyl]butyramide Formula: C20H18F3N3O2 MolecularWeight: 389.37103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CCCC(=O)NCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CCCC(=O)NCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3N3O2/c21-20(22,23)14-6-3-5-13(11-14)12-24-18(27)10-4-9-17-25-16-8-2-1-7-15(16)19(28)26-17/h1-3,5-8,11H,4,9-10,12H2,(H,24,27)(H,25,26,28)