3,5-dimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 3,5-dimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: 3,5-dimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide CAS Name: 3,5-dimethyl-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]benzenesulfonamide IUPAC Name: 3,5-dimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: 3,5-dimethyl-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]benzenesulfonamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4)C

InChI

InChI=1S/C22H24N4O2S/c1-16-12-17(2)14-20(13-16)29(27,28)25-19-7-5-6-18(15-19)21-8-9-22(24-23-21)26-10-3-4-11-26/h5-9,12-15,25H,3-4,10-11H2,1-2H3