N-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]-4-nitro-benzenesulfonamide CAS Name: N-[4-[6-(4-methyl-1-piperazinyl)-3-pyridazinyl]phenyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-[6-(4-methylpiperazino)pyridazin-3-yl]phenyl]-4-nitro-benzenesulfonamide Formula: C21H22N6O4S MolecularWeight: 454.50218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O4S/c1-25-12-14-26(15-13-25)21-11-10-20(22-23-21)16-2-4-17(5-3-16)24-32(30,31)19-8-6-18(7-9-19)27(28)29/h2-11,24H,12-15H2,1H3