2,4,5-trimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 2,4,5-trimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: 2,4,5-trimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide CAS Name: 2,4,5-trimethyl-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]benzenesulfonamide IUPAC Name: 2,4,5-trimethyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: 2,4,5-trimethyl-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]benzenesulfonamide Formula: C23H26N4O2S MolecularWeight: 422.54314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4)C

InChI

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