1-(phenylmethyl)-2-(8-phenyloctoxy)-5-(pyridin-3-ylmethyl)pyrimidin-4-one

Systemtic Name: 1-(phenylmethyl)-2-(8-phenyloctoxy)-5-(pyridin-3-ylmethyl)pyrimidin-4-one Openeye Name: 1-benzyl-2-(8-phenyloctoxy)-5-(3-pyridylmethyl)pyrimidin-4-one CAS Name: 1-(phenylmethyl)-2-(8-phenyloctoxy)-5-(3-pyridinylmethyl)-4-pyrimidinone IUPAC Name: 1-benzyl-2-(8-phenyloctoxy)-5-(pyridin-3-ylmethyl)pyrimidin-4-one Traditional Name: 1-benzyl-2-(8-phenyloctoxy)-5-(3-pyridylmethyl)pyrimidin-4-one Formula: C31H35N3O2 MolecularWeight: 481.6285

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCOC2=NC(=O)C(=CN2CC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCOC2=NC(=O)C(=CN2CC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C31H35N3O2/c35-30-29(22-28-19-13-20-32-23-28)25-34(24-27-17-10-6-11-18-27)31(33-30)36-21-12-4-2-1-3-7-14-26-15-8-5-9-16-26/h5-6,8-11,13,15-20,23,25H,1-4,7,12,14,21-22,24H2