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

Systemtic Name: 6-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-2-piperazin-1-yl-1H-pyrimidin-4-one Openeye Name: 6-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-2-piperazin-1-yl-1H-pyrimidin-4-one CAS Name: 6-[[4-[(4-chlorophenyl)methyl]-1-piperazinyl]methyl]-2-(1-piperazinyl)-1H-pyrimidin-4-one IUPAC Name: 6-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-2-piperazin-1-yl-1H-pyrimidin-4-one Traditional Name: 6-[[4-(4-chlorobenzyl)piperazino]methyl]-2-piperazino-1H-pyrimidin-4-one Formula: C20H27ClN6O MolecularWeight: 402.92098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC(=O)C=C(N2)CN3CCN(CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1)C2=NC(=O)C=C(N2)CN3CCN(CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H27ClN6O/c21-17-3-1-16(2-4-17)14-25-9-11-26(12-10-25)15-18-13-19(28)24-20(23-18)27-7-5-22-6-8-27/h1-4,13,22H,5-12,14-15H2,(H,23,24,28)