3-phenyl-2-[4-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one

Systemtic Name: 3-phenyl-2-[4-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one Openeye Name: 3-phenyl-2-[4-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one CAS Name: 3-phenyl-2-[4-[[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one IUPAC Name: 3-phenyl-2-[4-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one Traditional Name: 3-phenyl-2-[4-[[2-[4-(2-pyrimidyl)piperazino]ethylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one Formula: C31H31N7O MolecularWeight: 517.62414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNCC2=CC=C(C=C2)C3=C(C=C4C(=N3)C=CNC4=O)C5=CC=CC=C5)C6=NC=CC=N6

Isomeric SMILES

C1CN(CCN1CCNCC2=CC=C(C=C2)C3=C(C=C4C(=N3)C=CNC4=O)C5=CC=CC=C5)C6=NC=CC=N6

InChI

InChI=1S/C31H31N7O/c39-30-27-21-26(24-5-2-1-3-6-24)29(36-28(27)11-14-33-30)25-9-7-23(8-10-25)22-32-15-16-37-17-19-38(20-18-37)31-34-12-4-13-35-31/h1-14,21,32H,15-20,22H2,(H,33,39)