2-[5-cyano-2-(4-fluorophenyl)-6-(3-methylbut-2-enoxy)pyridin-3-yl]benzenesulfonamide

Systemtic Name: 2-[5-cyano-2-(4-fluorophenyl)-6-(3-methylbut-2-enoxy)pyridin-3-yl]benzenesulfonamide Openeye Name: 2-[5-cyano-2-(4-fluorophenyl)-6-(3-methylbut-2-enoxy)-3-pyridyl]benzenesulfonamide CAS Name: 2-[5-cyano-2-(4-fluorophenyl)-6-(3-methylbut-2-enoxy)-3-pyridinyl]benzenesulfonamide IUPAC Name: 2-[5-cyano-2-(4-fluorophenyl)-6-(3-methylbut-2-enoxy)pyridin-3-yl]benzenesulfonamide Traditional Name: 2-[5-cyano-2-(4-fluorophenyl)-6-(3-methylbut-2-enoxy)-3-pyridyl]benzenesulfonamide Formula: C23H20FN3O3S MolecularWeight: 437.486603

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=NC(=C(C=C1C#N)C2=CC=CC=C2S(=O)(=O)N)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC(=CCOC1=NC(=C(C=C1C#N)C2=CC=CC=C2S(=O)(=O)N)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C23H20FN3O3S/c1-15(2)11-12-30-23-17(14-25)13-20(19-5-3-4-6-21(19)31(26,28)29)22(27-23)16-7-9-18(24)10-8-16/h3-11,13H,12H2,1-2H3,(H2,26,28,29)