3-nitro-N-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]benzenesulfonamide Openeye Name: 3-nitro-N-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]benzenesulfonamide CAS Name: 3-nitro-N-[4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 3-nitro-N-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]benzenesulfonamide Traditional Name: 3-nitro-N-[4-[[4-(2-pyridyl)piperazino]methyl]phenyl]benzenesulfonamide Formula: C22H23N5O4S MolecularWeight: 453.51412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CC=N4

InChI

InChI=1S/C22H23N5O4S/c28-27(29)20-4-3-5-21(16-20)32(30,31)24-19-9-7-18(8-10-19)17-25-12-14-26(15-13-25)22-6-1-2-11-23-22/h1-11,16,24H,12-15,17H2