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

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-6-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrimidin-4-one Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-6-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrimidin-4-one CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-6-[(4-phenyl-1-piperazinyl)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-6-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrimidin-4-one Traditional Name: 2-[4-(3-chlorobenzyl)piperazino]-6-[(4-phenylpiperazino)methyl]-1H-pyrimidin-4-one Formula: C26H31ClN6O MolecularWeight: 479.01694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31ClN6O/c27-22-6-4-5-21(17-22)19-30-11-15-33(16-12-30)26-28-23(18-25(34)29-26)20-31-9-13-32(14-10-31)24-7-2-1-3-8-24/h1-8,17-18H,9-16,19-20H2,(H,28,29,34)