2-[2-[4-(6-bromanyl-4-phenyl-quinazolin-2-yl)piperazin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(6-bromanyl-4-phenyl-quinazolin-2-yl)piperazin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-(6-bromo-4-phenyl-quinazolin-2-yl)piperazin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-(6-bromo-4-phenyl-2-quinazolinyl)-1-piperazinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-(6-bromo-4-phenylquinazolin-2-yl)piperazin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[4-(6-bromo-4-phenyl-quinazolin-2-yl)piperazino]ethyl]isoindoline-1,3-quinone Formula: C28H24BrN5O2 MolecularWeight: 542.42646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C3=CC=CC=C3C2=O)C4=NC5=C(C=C(C=C5)Br)C(=N4)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C3=CC=CC=C3C2=O)C4=NC5=C(C=C(C=C5)Br)C(=N4)C6=CC=CC=C6

InChI

InChI=1S/C28H24BrN5O2/c29-20-10-11-24-23(18-20)25(19-6-2-1-3-7-19)31-28(30-24)33-15-12-32(13-16-33)14-17-34-26(35)21-8-4-5-9-22(21)27(34)36/h1-11,18H,12-17H2