N-[4-[2-(4-pyridin-3-ylpiperazin-1-yl)ethanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-(4-pyridin-3-ylpiperazin-1-yl)ethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-[4-(3-pyridyl)piperazin-1-yl]acetyl]phenyl]methanesulfonamide CAS Name: N-[4-[1-oxo-2-[4-(3-pyridinyl)-1-piperazinyl]ethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-(4-pyridin-3-ylpiperazin-1-yl)acetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[4-(3-pyridyl)piperazino]acetyl]phenyl]methanesulfonamide Formula: C18H22N4O3S MolecularWeight: 374.45728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=CN=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=CN=CC=C3

InChI

InChI=1S/C18H22N4O3S/c1-26(24,25)20-16-6-4-15(5-7-16)18(23)14-21-9-11-22(12-10-21)17-3-2-8-19-13-17/h2-8,13,20H,9-12,14H2,1H3