2-[4-(phenylmethyl)piperazin-1-yl]pyrimido[2,1-a]isoquinolin-4-one

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]pyrimido[2,1-a]isoquinolin-4-one Openeye Name: 2-(4-benzylpiperazin-1-yl)pyrimido[2,1-a]isoquinolin-4-one CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimido[2,1-a]isoquinolinone IUPAC Name: 2-(4-benzylpiperazin-1-yl)pyrimido[2,1-a]isoquinolin-4-one Traditional Name: 2-(4-benzylpiperazino)pyrimid[2,1-a]isoquinolin-4-one Formula: C23H22N4O MolecularWeight: 370.44698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC(=O)N4C=CC5=CC=CC=C5C4=N3

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC(=O)N4C=CC5=CC=CC=C5C4=N3

InChI

InChI=1S/C23H22N4O/c28-22-16-21(24-23-20-9-5-4-8-19(20)10-11-27(22)23)26-14-12-25(13-15-26)17-18-6-2-1-3-7-18/h1-11,16H,12-15,17H2