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

Systemtic Name: 3-(3-bromophenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(3-bromophenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(3-bromophenyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromophenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(3-bromophenyl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C17H19BrN4O MolecularWeight: 375.26296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19BrN4O/c18-15-4-1-3-14(13-15)5-6-16(23)21-9-11-22(12-10-21)17-19-7-2-8-20-17/h1-4,7-8,13H,5-6,9-12H2