2-(4-dimethylaminophenyl)-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 2-(4-dimethylaminophenyl)-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(4-dimethylaminophenyl)quinazolin-4-one CAS Name: 2-(4-dimethylaminophenyl)-3-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(4-dimethylaminophenyl)quinazolin-4-one Traditional Name: 3-[2-(4-benzylpiperazino)ethyl]-2-(4-dimethylaminophenyl)quinazolin-4-one Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2CCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2CCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H33N5O/c1-31(2)25-14-12-24(13-15-25)28-30-27-11-7-6-10-26(27)29(35)34(28)21-20-32-16-18-33(19-17-32)22-23-8-4-3-5-9-23/h3-15H,16-22H2,1-2H3