1-(4-methylpyridin-2-yl)-3-[3-(phenylmethyl)-5-(pyridin-2-ylmethyl)phenyl]propane-1,3-dione

Systemtic Name: 1-(4-methylpyridin-2-yl)-3-[3-(phenylmethyl)-5-(pyridin-2-ylmethyl)phenyl]propane-1,3-dione Openeye Name: 1-[3-benzyl-5-(2-pyridylmethyl)phenyl]-3-(4-methyl-2-pyridyl)propane-1,3-dione CAS Name: 1-(4-methyl-2-pyridinyl)-3-[3-(phenylmethyl)-5-(2-pyridinylmethyl)phenyl]propane-1,3-dione IUPAC Name: 1-[3-benzyl-5-(pyridin-2-ylmethyl)phenyl]-3-(4-methylpyridin-2-yl)propane-1,3-dione Traditional Name: 1-[3-benzyl-5-(2-pyridylmethyl)phenyl]-3-(4-methyl-2-pyridyl)propane-1,3-dione Formula: C28H24N2O2 MolecularWeight: 420.50236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(=O)CC(=O)C2=CC(=CC(=C2)CC3=CC=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC=C1)C(=O)CC(=O)C2=CC(=CC(=C2)CC3=CC=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C28H24N2O2/c1-20-10-12-30-26(13-20)28(32)19-27(31)24-16-22(14-21-7-3-2-4-8-21)15-23(17-24)18-25-9-5-6-11-29-25/h2-13,15-17H,14,18-19H2,1H3