2-[4-[[[(1S)-2-methoxy-1-pyridin-2-yl-ethyl]-methyl-amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[[[(1S)-2-methoxy-1-pyridin-2-yl-ethyl]-methyl-amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[4-[[[(1S)-2-methoxy-1-(2-pyridyl)ethyl]-methyl-amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[4-[[[(1S)-2-methoxy-1-(2-pyridinyl)ethyl]-methylamino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[4-[[[(1S)-2-methoxy-1-pyridin-2-ylethyl]-methylamino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[4-[[[(1S)-2-methoxy-1-(2-pyridyl)ethyl]-methyl-amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)C2=CC=C(C=C2)CN(C)C(COC)C3=CC=CC=N3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)C2=CC=C(C=C2)CN(C)[C@H](COC)C3=CC=CC=N3

InChI

InChI=1S/C23H28N4O2/c1-4-7-19-14-22(28)26-23(25-19)18-11-9-17(10-12-18)15-27(2)21(16-29-3)20-8-5-6-13-24-20/h5-6,8-14,21H,4,7,15-16H2,1-3H3,(H,25,26,28)/t21-/m1/s1