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

Systemtic Name: 2-[(4-aminophenyl)methyl]-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one Openeye Name: 2-[(4-aminophenyl)methyl]-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one CAS Name: 2-[(4-aminophenyl)methyl]-1-[2-(4-phenyl-1-piperazinyl)ethyl]-2,3-dihydroquinazolin-4-one IUPAC Name: 2-[(4-aminophenyl)methyl]-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one Traditional Name: 2-(4-aminobenzyl)-1-[2-(4-phenylpiperazino)ethyl]-2,3-dihydroquinazolin-4-one Formula: C27H31N5O MolecularWeight: 441.56794

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(NC(=O)C3=CC=CC=C32)CC4=CC=C(C=C4)N)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCN2C(NC(=O)C3=CC=CC=C32)CC4=CC=C(C=C4)N)C5=CC=CC=C5

InChI

InChI=1S/C27H31N5O/c28-22-12-10-21(11-13-22)20-26-29-27(33)24-8-4-5-9-25(24)32(26)19-16-30-14-17-31(18-15-30)23-6-2-1-3-7-23/h1-13,26H,14-20,28H2,(H,29,33)