[4-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [4-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [4-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [4-[(6-bromo-4-phenyl-2-quinazolinyl)amino]phenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [4-[(6-bromo-4-phenylquinazolin-2-yl)amino]phenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [4-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]phenyl]-(4-phenylpiperazino)methanone Formula: C31H26BrN5O MolecularWeight: 564.47504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)NC4=NC5=C(C=C(C=C5)Br)C(=N4)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)NC4=NC5=C(C=C(C=C5)Br)C(=N4)C6=CC=CC=C6

InChI

InChI=1S/C31H26BrN5O/c32-24-13-16-28-27(21-24)29(22-7-3-1-4-8-22)35-31(34-28)33-25-14-11-23(12-15-25)30(38)37-19-17-36(18-20-37)26-9-5-2-6-10-26/h1-16,21H,17-20H2,(H,33,34,35)