2,4-dimethyl-N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 2,4-dimethyl-N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: 2,4-dimethyl-N-[3-[6-(1-piperidyl)pyridazin-3-yl]phenyl]benzenesulfonamide CAS Name: 2,4-dimethyl-N-[3-[6-(1-piperidinyl)-3-pyridazinyl]phenyl]benzenesulfonamide IUPAC Name: 2,4-dimethyl-N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: 2,4-dimethyl-N-[3-(6-piperidinopyridazin-3-yl)phenyl]benzenesulfonamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCC4)C

InChI

InChI=1S/C23H26N4O2S/c1-17-9-11-22(18(2)15-17)30(28,29)26-20-8-6-7-19(16-20)21-10-12-23(25-24-21)27-13-4-3-5-14-27/h6-12,15-16,26H,3-5,13-14H2,1-2H3