3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[[2-(ethoxymethyl)phenyl]methyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[2-(ethoxymethyl)benzyl]propionamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=CC=C1CNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCOCC1=CC=CC=C1CNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O3/c1-2-28-13-16-6-4-3-5-15(16)12-23-20(26)9-10-25-14-24-19-8-7-17(22)11-18(19)21(25)27/h3-8,11,14H,2,9-10,12-13H2,1H3,(H,23,26)