3-fluoranyl-4-methoxy-N-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-methoxy-N-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: 3-fluoro-4-methoxy-N-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide CAS Name: 3-fluoro-4-methoxy-N-[4-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]benzenesulfonamide IUPAC Name: 3-fluoro-4-methoxy-N-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: 3-fluoro-4-methoxy-N-[4-(6-pyrrolidinopyridazin-3-yl)phenyl]benzenesulfonamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(C=C3)N4CCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(C=C3)N4CCCC4)F

InChI

InChI=1S/C21H21FN4O3S/c1-29-20-10-8-17(14-18(20)22)30(27,28)25-16-6-4-15(5-7-16)19-9-11-21(24-23-19)26-12-2-3-13-26/h4-11,14,25H,2-3,12-13H2,1H3