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

Systemtic Name: 3-(phenylsulfonyl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(benzenesulfonyl)-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(benzenesulfonyl)-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(benzenesulfonyl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-besyl-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O3S/c22-18(9-15-25(23,24)16-6-2-1-3-7-16)21-13-11-20(12-14-21)17-8-4-5-10-19-17/h1-8,10H,9,11-15H2