2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[4-(cyanomethyl)phenyl]ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-(6-bromo-4-oxo-quinazolin-3-yl)-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-(6-bromo-4-oxo-3-quinazolinyl)-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-(6-bromo-4-oxoquinazolin-3-yl)-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-(6-bromo-4-keto-quinazolin-3-yl)-N-[4-(cyanomethyl)phenyl]acetamide Formula: C18H13BrN4O2 MolecularWeight: 397.22542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1CC#N)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H13BrN4O2/c19-13-3-6-16-15(9-13)18(25)23(11-21-16)10-17(24)22-14-4-1-12(2-5-14)7-8-20/h1-6,9,11H,7,10H2,(H,22,24)