2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)ethanamide Openeye Name: 2-(6-bromo-4-oxo-quinazolin-3-yl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide CAS Name: 2-(6-bromo-4-oxo-3-quinazolinyl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide IUPAC Name: 2-(6-bromo-4-oxoquinazolin-3-yl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide Traditional Name: 2-(6-bromo-4-keto-quinazolin-3-yl)-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)acetamide Formula: C21H19BrN4O2 MolecularWeight: 439.30516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br)C

InChI

InChI=1S/C21H19BrN4O2/c1-14-8-15(2)10-17(9-14)26(7-3-6-23)20(27)12-25-13-24-19-5-4-16(22)11-18(19)21(25)28/h4-5,8-11,13H,3,7,12H2,1-2H3