3-methyl-2-[3-[4-(4-methylpiperazin-1-yl)phenyl]piperazin-1-yl]-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 3-methyl-2-[3-[4-(4-methylpiperazin-1-yl)phenyl]piperazin-1-yl]-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 3-methyl-2-[3-[4-(4-methylpiperazin-1-yl)phenyl]piperazin-1-yl]-6-(4-pyridyl)pyrimidin-4-one CAS Name: 3-methyl-2-[3-[4-(4-methyl-1-piperazinyl)phenyl]-1-piperazinyl]-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 3-methyl-2-[3-[4-(4-methylpiperazin-1-yl)phenyl]piperazin-1-yl]-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 3-methyl-2-[3-[4-(4-methylpiperazino)phenyl]piperazino]-6-(4-pyridyl)pyrimidin-4-one Formula: C25H31N7O MolecularWeight: 445.55994

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)C3CN(CCN3)C4=NC(=CC(=O)N4C)C5=CC=NC=C5

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)C3CN(CCN3)C4=NC(=CC(=O)N4C)C5=CC=NC=C5

InChI

InChI=1S/C25H31N7O/c1-29-13-15-31(16-14-29)21-5-3-19(4-6-21)23-18-32(12-11-27-23)25-28-22(17-24(33)30(25)2)20-7-9-26-10-8-20/h3-10,17,23,27H,11-16,18H2,1-2H3