5-fluoranyl-2-methoxy-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 5-fluoranyl-2-methoxy-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: 5-fluoro-2-methoxy-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide CAS Name: 5-fluoro-2-methoxy-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]benzenesulfonamide IUPAC Name: 5-fluoro-2-methoxy-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: 5-fluoro-2-methoxy-N-[3-(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)F)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4

Isomeric SMILES

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

InChI

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