N,N-diethyl-2-methoxy-5-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N,N-diethyl-2-methoxy-5-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N,N-diethyl-2-methoxy-5-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N,N-diethyl-2-methoxy-5-[oxo-[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N,N-diethyl-2-methoxy-5-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N,N-diethyl-2-methoxy-5-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C22H30N4O4S MolecularWeight: 446.563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=N3)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=N3)OC

InChI

InChI=1S/C22H30N4O4S/c1-4-26(5-2)31(28,29)21-16-18(9-10-20(21)30-3)22(27)25-14-12-24(13-15-25)17-19-8-6-7-11-23-19/h6-11,16H,4-5,12-15,17H2,1-3H3