3-(4-bromophenyl)-2-[6-ethanoyl-3-(4-methylphenyl)-5-oxidanylidene-cyclohex-3-en-1-yl]quinazolin-4-one

Systemtic Name: 3-(4-bromophenyl)-2-[6-ethanoyl-3-(4-methylphenyl)-5-oxidanylidene-cyclohex-3-en-1-yl]quinazolin-4-one Openeye Name: 2-[6-acetyl-5-oxo-3-(p-tolyl)cyclohex-3-en-1-yl]-3-(4-bromophenyl)quinazolin-4-one CAS Name: 2-[6-acetyl-3-(4-methylphenyl)-5-oxo-1-cyclohex-3-enyl]-3-(4-bromophenyl)-4-quinazolinone IUPAC Name: 2-[6-acetyl-3-(4-methylphenyl)-5-oxocyclohex-3-en-1-yl]-3-(4-bromophenyl)quinazolin-4-one Traditional Name: 2-[6-acetyl-5-keto-3-(p-tolyl)cyclohex-3-en-1-yl]-3-(4-bromophenyl)quinazolin-4-one Formula: C29H23BrN2O3 MolecularWeight: 527.40852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)C(C(C2)C3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)Br)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)C(C(C2)C3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)Br)C(=O)C

InChI

InChI=1S/C29H23BrN2O3/c1-17-7-9-19(10-8-17)20-15-24(27(18(2)33)26(34)16-20)28-31-25-6-4-3-5-23(25)29(35)32(28)22-13-11-21(30)12-14-22/h3-14,16,24,27H,15H2,1-2H3