3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]propionamide Formula: C20H18BrF3N4O2 MolecularWeight: 483.28173

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(F)(F)F)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(F)(F)F)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C20H18BrF3N4O2/c1-27(2)17-6-3-12(20(22,23)24)9-16(17)26-18(29)7-8-28-11-25-15-5-4-13(21)10-14(15)19(28)30/h3-6,9-11H,7-8H2,1-2H3,(H,26,29)