5-bromanyl-2-ethoxy-N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: 5-bromo-2-ethoxy-N-[3-[6-(1-piperidyl)pyridazin-3-yl]phenyl]benzenesulfonamide CAS Name: 5-bromo-2-ethoxy-N-[3-[6-(1-piperidinyl)-3-pyridazinyl]phenyl]benzenesulfonamide IUPAC Name: 5-bromo-2-ethoxy-N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: 5-bromo-2-ethoxy-N-[3-(6-piperidinopyridazin-3-yl)phenyl]benzenesulfonamide Formula: C23H25BrN4O3S MolecularWeight: 517.4386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCC4

InChI

InChI=1S/C23H25BrN4O3S/c1-2-31-21-11-9-18(24)16-22(21)32(29,30)27-19-8-6-7-17(15-19)20-10-12-23(26-25-20)28-13-4-3-5-14-28/h6-12,15-16,27H,2-5,13-14H2,1H3