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

Systemtic Name: 3-methyl-6-pyridin-4-yl-2-[3-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]pyrimidin-4-one Openeye Name: 3-methyl-6-(4-pyridyl)-2-[3-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]pyrimidin-4-one CAS Name: 3-methyl-6-pyridin-4-yl-2-[3-[4-(1-pyrrolidinyl)phenyl]-1-piperazinyl]-4-pyrimidinone IUPAC Name: 3-methyl-6-pyridin-4-yl-2-[3-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]pyrimidin-4-one Traditional Name: 3-methyl-6-(4-pyridyl)-2-[3-(4-pyrrolidinophenyl)piperazino]pyrimidin-4-one Formula: C24H28N6O MolecularWeight: 416.51872

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=CC=C(C=C3)N4CCCC4)C5=CC=NC=C5

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=CC=C(C=C3)N4CCCC4)C5=CC=NC=C5

InChI

InChI=1S/C24H28N6O/c1-28-23(31)16-21(19-8-10-25-11-9-19)27-24(28)30-15-12-26-22(17-30)18-4-6-20(7-5-18)29-13-2-3-14-29/h4-11,16,22,26H,2-3,12-15,17H2,1H3