6-ethyl-2-[3-[[isoquinolin-5-ylmethyl(methyl)amino]methyl]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[3-[[isoquinolin-5-ylmethyl(methyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Openeye Name: 6-ethyl-2-[3-[[5-isoquinolylmethyl(methyl)amino]methyl]phenyl]-1H-pyrimidin-4-one CAS Name: 6-ethyl-2-[3-[[5-isoquinolinylmethyl(methyl)amino]methyl]phenyl]-1H-pyrimidin-4-one IUPAC Name: 6-ethyl-2-[3-[[isoquinolin-5-ylmethyl(methyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Traditional Name: 6-ethyl-2-[3-[[5-isoquinolylmethyl(methyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Formula: C24H24N4O MolecularWeight: 384.47356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)C2=CC(=CC=C2)CN(C)CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CCC1=CC(=O)N=C(N1)C2=CC(=CC=C2)CN(C)CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C24H24N4O/c1-3-21-13-23(29)27-24(26-21)18-7-4-6-17(12-18)15-28(2)16-20-9-5-8-19-14-25-11-10-22(19)20/h4-14H,3,15-16H2,1-2H3,(H,26,27,29)