3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[3-(trifluoromethyl)benzyl]propionamide Formula: C19H15BrF3N3O2 MolecularWeight: 454.24051

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C19H15BrF3N3O2/c20-14-4-5-16-15(9-14)18(28)26(11-25-16)7-6-17(27)24-10-12-2-1-3-13(8-12)19(21,22)23/h1-5,8-9,11H,6-7,10H2,(H,24,27)