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

Systemtic Name: 4-ethanoyl-N-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]benzenesulfonamide Openeye Name: 4-acetyl-N-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]benzenesulfonamide CAS Name: 4-acetyl-N-[4-[6-(4-methyl-1-piperazinyl)-3-pyridazinyl]phenyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[4-[6-(4-methylpiperazino)pyridazin-3-yl]phenyl]benzenesulfonamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(C=C3)N4CCN(CC4)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(C=C3)N4CCN(CC4)C

InChI

InChI=1S/C23H25N5O3S/c1-17(29)18-5-9-21(10-6-18)32(30,31)26-20-7-3-19(4-8-20)22-11-12-23(25-24-22)28-15-13-27(2)14-16-28/h3-12,26H,13-16H2,1-2H3