1-[[3-methoxy-5-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methyl]quinolin-2-one

Systemtic Name: 1-[[3-methoxy-5-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methyl]quinolin-2-one Openeye Name: 1-[[3-methoxy-5-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methyl]quinolin-2-one CAS Name: 1-[[3-methoxy-5-[4-(2-pyrimidinyl)-1-piperazinyl]phenyl]methyl]-2-quinolinone IUPAC Name: 1-[[3-methoxy-5-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methyl]quinolin-2-one Traditional Name: 1-[3-methoxy-5-[4-(2-pyrimidyl)piperazino]benzyl]carbostyril Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CCN(CC2)C3=NC=CC=N3)CN4C(=O)C=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC(=CC(=C1)N2CCN(CC2)C3=NC=CC=N3)CN4C(=O)C=CC5=CC=CC=C54

InChI

InChI=1S/C25H25N5O2/c1-32-22-16-19(18-30-23-6-3-2-5-20(23)7-8-24(30)31)15-21(17-22)28-11-13-29(14-12-28)25-26-9-4-10-27-25/h2-10,15-17H,11-14,18H2,1H3