6-[(4-phenylpiperazin-1-yl)methyl]-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(4-phenylpiperazin-1-yl)methyl]-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(4-phenylpiperazin-1-yl)methyl]-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]-1H-pyrimidin-4-one CAS Name: 2-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]-6-[(4-phenyl-1-piperazinyl)methyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(4-phenylpiperazin-1-yl)methyl]-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]-1H-pyrimidin-4-one Traditional Name: 2-[4-[(E)-3-phenylacryloyl]piperazino]-6-[(4-phenylpiperazino)methyl]-1H-pyrimidin-4-one Formula: C28H32N6O2 MolecularWeight: 484.59268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H32N6O2/c35-26-21-24(22-31-13-15-32(16-14-31)25-9-5-2-6-10-25)29-28(30-26)34-19-17-33(18-20-34)27(36)12-11-23-7-3-1-4-8-23/h1-12,21H,13-20,22H2,(H,29,30,35)/b12-11+