methyl 4,6-bis(6-pyridin-2-ylpyridin-2-yl)pyrimidine-2-carboxylate

Systemtic Name: methyl 4,6-bis(6-pyridin-2-ylpyridin-2-yl)pyrimidine-2-carboxylate Openeye Name: methyl 4,6-bis[6-(2-pyridyl)-2-pyridyl]pyrimidine-2-carboxylate CAS Name: 4,6-bis[6-(2-pyridinyl)-2-pyridinyl]-2-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4,6-bis(6-pyridin-2-ylpyridin-2-yl)pyrimidine-2-carboxylate Traditional Name: 4,6-bis[6-(2-pyridyl)-2-pyridyl]pyrimidine-2-carboxylic acid methyl ester Formula: C26H18N6O2 MolecularWeight: 446.46012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=CC(=N1)C2=CC=CC(=N2)C3=CC=CC=N3)C4=CC=CC(=N4)C5=CC=CC=N5

Isomeric SMILES

COC(=O)C1=NC(=CC(=N1)C2=CC=CC(=N2)C3=CC=CC=N3)C4=CC=CC(=N4)C5=CC=CC=N5

InChI

InChI=1S/C26H18N6O2/c1-34-26(33)25-31-23(21-12-6-10-19(29-21)17-8-2-4-14-27-17)16-24(32-25)22-13-7-11-20(30-22)18-9-3-5-15-28-18/h2-16H,1H3