3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-methyl-6-propan-2-yl-phenyl)propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-methyl-6-propan-2-yl-phenyl)propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-(2-isopropyl-6-methyl-phenyl)propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-(2-methyl-6-propan-2-ylphenyl)propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-(2-methyl-6-propan-2-ylphenyl)propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-(2-isopropyl-6-methyl-phenyl)propionamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O2/c1-13(2)16-6-4-5-14(3)20(16)24-19(26)9-10-25-12-23-18-8-7-15(22)11-17(18)21(25)27/h4-8,11-13H,9-10H2,1-3H3,(H,24,26)