N-[5-cyano-2-(4-fluorophenyl)-6-(furan-3-ylmethylsulfanyl)pyridin-3-yl]benzenesulfonamide

Systemtic Name: N-[5-cyano-2-(4-fluorophenyl)-6-(furan-3-ylmethylsulfanyl)pyridin-3-yl]benzenesulfonamide Openeye Name: N-[5-cyano-2-(4-fluorophenyl)-6-(3-furylmethylsulfanyl)-3-pyridyl]benzenesulfonamide CAS Name: N-[5-cyano-2-(4-fluorophenyl)-6-(3-furanylmethylthio)-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[5-cyano-2-(4-fluorophenyl)-6-(furan-3-ylmethylsulfanyl)pyridin-3-yl]benzenesulfonamide Traditional Name: N-[5-cyano-2-(4-fluorophenyl)-6-(3-furfurylthio)-3-pyridyl]benzenesulfonamide Formula: C23H16FN3O3S2 MolecularWeight: 465.519843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=C(N=C(C(=C2)C#N)SCC3=COC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=C(N=C(C(=C2)C#N)SCC3=COC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H16FN3O3S2/c24-19-8-6-17(7-9-19)22-21(27-32(28,29)20-4-2-1-3-5-20)12-18(13-25)23(26-22)31-15-16-10-11-30-14-16/h1-12,14,27H,15H2