4-tert-butyl-N-[2-[(6-oxidanylidene-3-piperazin-1-yl-pyridazin-1-yl)methyl]phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-[(6-oxidanylidene-3-piperazin-1-yl-pyridazin-1-yl)methyl]phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-[(6-oxo-3-piperazin-1-yl-pyridazin-1-yl)methyl]phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-[[6-oxo-3-(1-piperazinyl)-1-pyridazinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-[(6-oxo-3-piperazin-1-ylpyridazin-1-yl)methyl]phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[2-[(6-keto-3-piperazino-pyridazin-1-yl)methyl]phenyl]benzenesulfonamide Formula: C25H31N5O3S MolecularWeight: 481.61034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2CN3C(=O)C=CC(=N3)N4CCNCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2CN3C(=O)C=CC(=N3)N4CCNCC4

InChI

InChI=1S/C25H31N5O3S/c1-25(2,3)20-8-10-21(11-9-20)34(32,33)28-22-7-5-4-6-19(22)18-30-24(31)13-12-23(27-30)29-16-14-26-15-17-29/h4-13,26,28H,14-18H2,1-3H3