6-methyl-2-oxidanyl-1-(phenylmethyl)-3-[pyridin-4-yl-(4-pyridin-2-ylpiperazin-1-yl)methyl]pyridin-4-one

Systemtic Name: 6-methyl-2-oxidanyl-1-(phenylmethyl)-3-[pyridin-4-yl-(4-pyridin-2-ylpiperazin-1-yl)methyl]pyridin-4-one Openeye Name: 1-benzyl-2-hydroxy-6-methyl-3-[4-pyridyl-[4-(2-pyridyl)piperazin-1-yl]methyl]pyridin-4-one CAS Name: 2-hydroxy-6-methyl-1-(phenylmethyl)-3-[pyridin-4-yl-[4-(2-pyridinyl)-1-piperazinyl]methyl]-4-pyridinone IUPAC Name: 1-benzyl-2-hydroxy-6-methyl-3-[pyridin-4-yl-(4-pyridin-2-ylpiperazin-1-yl)methyl]pyridin-4-one Traditional Name: 1-benzyl-2-hydroxy-6-methyl-3-[4-pyridyl-[4-(2-pyridyl)piperazino]methyl]-4-pyridone Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC2=CC=CC=C2)O)C(C3=CC=NC=C3)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC2=CC=CC=C2)O)C(C3=CC=NC=C3)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C28H29N5O2/c1-21-19-24(34)26(28(35)33(21)20-22-7-3-2-4-8-22)27(23-10-13-29-14-11-23)32-17-15-31(16-18-32)25-9-5-6-12-30-25/h2-14,19,27,35H,15-18,20H2,1H3