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

Systemtic Name: 1-(4-methylpyridin-2-yl)-3-[3-(pyrimidin-2-ylmethyl)phenyl]propane-1,3-dione Openeye Name: 1-(4-methyl-2-pyridyl)-3-[3-(pyrimidin-2-ylmethyl)phenyl]propane-1,3-dione CAS Name: 1-(4-methyl-2-pyridinyl)-3-[3-(2-pyrimidinylmethyl)phenyl]propane-1,3-dione IUPAC Name: 1-(4-methylpyridin-2-yl)-3-[3-(pyrimidin-2-ylmethyl)phenyl]propane-1,3-dione Traditional Name: 1-(4-methyl-2-pyridyl)-3-[3-(2-pyrimidylmethyl)phenyl]propane-1,3-dione Formula: C20H17N3O2 MolecularWeight: 331.36788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O2/c1-14-6-9-21-17(10-14)19(25)13-18(24)16-5-2-4-15(11-16)12-20-22-7-3-8-23-20/h2-11H,12-13H2,1H3