methyl 6-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylpyridine-2-carboxylate

Systemtic Name: methyl 6-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylpyridine-2-carboxylate Openeye Name: methyl 6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxylate CAS Name: 6-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxylate Traditional Name: 6-[4-(2-pyrimidyl)piperazine-1-carbonyl]picolinic acid methyl ester Formula: C16H17N5O3 MolecularWeight: 327.33788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=N1)C(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

COC(=O)C1=CC=CC(=N1)C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H17N5O3/c1-24-15(23)13-5-2-4-12(19-13)14(22)20-8-10-21(11-9-20)16-17-6-3-7-18-16/h2-7H,8-11H2,1H3