N-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-3-fluoranyl-4-methoxy-benzenesulfonamide

Systemtic Name: N-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-3-fluoranyl-4-methoxy-benzenesulfonamide Openeye Name: N-[2-[3-(4-ethoxyphenyl)-6-oxo-pyridazin-1-yl]ethyl]-3-fluoro-4-methoxy-benzenesulfonamide CAS Name: N-[2-[3-(4-ethoxyphenyl)-6-oxo-1-pyridazinyl]ethyl]-3-fluoro-4-methoxybenzenesulfonamide IUPAC Name: N-[2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]ethyl]-3-fluoro-4-methoxybenzenesulfonamide Traditional Name: 3-fluoro-N-[2-(6-keto-3-p-phenetyl-pyridazin-1-yl)ethyl]-4-methoxy-benzenesulfonamide Formula: C21H22FN3O5S MolecularWeight: 447.479883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H22FN3O5S/c1-3-30-16-6-4-15(5-7-16)19-9-11-21(26)25(24-19)13-12-23-31(27,28)17-8-10-20(29-2)18(22)14-17/h4-11,14,23H,3,12-13H2,1-2H3