propan-2-yl 4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]benzoate Openeye Name: isopropyl 4-[3-(6-bromo-4-oxo-quinazolin-3-yl)propanoylamino]benzoate CAS Name: 4-[[3-(6-bromo-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(6-bromo-4-oxoquinazolin-3-yl)propanoylamino]benzoate Traditional Name: 4-[3-(6-bromo-4-keto-quinazolin-3-yl)propanoylamino]benzoic acid isopropyl ester Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C21H20BrN3O4/c1-13(2)29-21(28)14-3-6-16(7-4-14)24-19(26)9-10-25-12-23-18-8-5-15(22)11-17(18)20(25)27/h3-8,11-13H,9-10H2,1-2H3,(H,24,26)