2-(3-bromophenyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one

Systemtic Name: 2-(3-bromophenyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one Openeye Name: 2-(3-bromophenyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one CAS Name: 2-(3-bromophenyl)-1-[2-(4-phenyl-1-piperazinyl)ethyl]-2,3-dihydroquinazolin-4-one IUPAC Name: 2-(3-bromophenyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one Traditional Name: 2-(3-bromophenyl)-1-[2-(4-phenylpiperazino)ethyl]-2,3-dihydroquinazolin-4-one Formula: C26H27BrN4O MolecularWeight: 491.42278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(NC(=O)C3=CC=CC=C32)C4=CC(=CC=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCN2C(NC(=O)C3=CC=CC=C32)C4=CC(=CC=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C26H27BrN4O/c27-21-8-6-7-20(19-21)25-28-26(32)23-11-4-5-12-24(23)31(25)18-15-29-13-16-30(17-14-29)22-9-2-1-3-10-22/h1-12,19,25H,13-18H2,(H,28,32)