N-(5-acetamido-2-methoxy-phenyl)-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-3-(6-bromo-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-3-(6-bromo-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-3-(6-bromo-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-3-(6-bromo-4-keto-quinazolin-3-yl)propionamide Formula: C20H19BrN4O4 MolecularWeight: 459.29326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C20H19BrN4O4/c1-12(26)23-14-4-6-18(29-2)17(10-14)24-19(27)7-8-25-11-22-16-5-3-13(21)9-15(16)20(25)28/h3-6,9-11H,7-8H2,1-2H3,(H,23,26)(H,24,27)