2-(6-bromanyl-2-oxidanylidene-1-propyl-quinolin-4-yl)-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-(6-bromanyl-2-oxidanylidene-1-propyl-quinolin-4-yl)-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-(6-bromo-2-oxo-1-propyl-4-quinolyl)quinazolin-4-one CAS Name: 2-(6-bromo-2-oxo-1-propyl-4-quinolinyl)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-(6-bromo-2-oxo-1-propylquinolin-4-yl)quinazolin-4-one Traditional Name: 3-benzyl-2-(6-bromo-2-keto-1-propyl-4-quinolyl)quinazolin-4-one Formula: C27H22BrN3O2 MolecularWeight: 500.38648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Br)C(=CC1=O)C3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Br)C(=CC1=O)C3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C27H22BrN3O2/c1-2-14-30-24-13-12-19(28)15-21(24)22(16-25(30)32)26-29-23-11-7-6-10-20(23)27(33)31(26)17-18-8-4-3-5-9-18/h3-13,15-16H,2,14,17H2,1H3