1-[3-[(2-oxidanylidenepyrimidin-1-yl)methyl]-5-(phenylmethyl)phenyl]-3-pyridin-2-yl-propane-1,3-dione

Systemtic Name: 1-[3-[(2-oxidanylidenepyrimidin-1-yl)methyl]-5-(phenylmethyl)phenyl]-3-pyridin-2-yl-propane-1,3-dione Openeye Name: 1-[3-benzyl-5-[(2-oxopyrimidin-1-yl)methyl]phenyl]-3-(2-pyridyl)propane-1,3-dione CAS Name: 1-[3-[(2-oxo-1-pyrimidinyl)methyl]-5-(phenylmethyl)phenyl]-3-(2-pyridinyl)propane-1,3-dione IUPAC Name: 1-[3-benzyl-5-[(2-oxopyrimidin-1-yl)methyl]phenyl]-3-pyridin-2-ylpropane-1,3-dione Traditional Name: 1-[3-benzyl-5-[(2-ketopyrimidin-1-yl)methyl]phenyl]-3-(2-pyridyl)propane-1,3-dione Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)CC(=O)C3=CC=CC=N3)CN4C=CC=NC4=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)CC(=O)C3=CC=CC=N3)CN4C=CC=NC4=O

InChI

InChI=1S/C26H21N3O3/c30-24(17-25(31)23-9-4-5-10-27-23)22-15-20(13-19-7-2-1-3-8-19)14-21(16-22)18-29-12-6-11-28-26(29)32/h1-12,14-16H,13,17-18H2