3-pyridin-3-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-pyridin-3-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(3-pyridyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(3-pyridinyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-pyridin-3-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(3-pyridyl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C16H19N5O MolecularWeight: 297.35496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C16H19N5O/c22-15(5-4-14-3-1-6-17-13-14)20-9-11-21(12-10-20)16-18-7-2-8-19-16/h1-3,6-8,13H,4-5,9-12H2