2-[4-[7-(2-methyl-1-oxidanyl-propyl)naphthalen-1-yl]piperazin-1-yl]-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[7-(2-methyl-1-oxidanyl-propyl)naphthalen-1-yl]piperazin-1-yl]-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[4-[7-(1-hydroxy-2-methyl-propyl)-1-naphthyl]piperazin-1-yl]-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[4-[7-(1-hydroxy-2-methylpropyl)-1-naphthalenyl]-1-piperazinyl]-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-[4-[7-(1-hydroxy-2-methylpropyl)naphthalen-1-yl]piperazin-1-yl]-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[4-[7-(1-hydroxy-2-methyl-propyl)-1-naphthyl]piperazino]-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=CC=C2N3CCN(CC3)C4=NC(=O)C=C(N4)C5=CC=NC=C5)C=C1)O

Isomeric SMILES

CC(C)C(C1=CC2=C(C=CC=C2N3CCN(CC3)C4=NC(=O)C=C(N4)C5=CC=NC=C5)C=C1)O

InChI

InChI=1S/C27H29N5O2/c1-18(2)26(34)21-7-6-19-4-3-5-24(22(19)16-21)31-12-14-32(15-13-31)27-29-23(17-25(33)30-27)20-8-10-28-11-9-20/h3-11,16-18,26,34H,12-15H2,1-2H3,(H,29,30,33)