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

Systemtic Name: N-[5-cyano-2-(4-fluorophenyl)-6-phenacylsulfanyl-pyridin-3-yl]benzenesulfonamide Openeye Name: N-[5-cyano-2-(4-fluorophenyl)-6-phenacylsulfanyl-3-pyridyl]benzenesulfonamide CAS Name: N-[5-cyano-2-(4-fluorophenyl)-6-(phenacylthio)-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[5-cyano-2-(4-fluorophenyl)-6-phenacylsulfanylpyridin-3-yl]benzenesulfonamide Traditional Name: N-[5-cyano-2-(4-fluorophenyl)-6-(phenacylthio)-3-pyridyl]benzenesulfonamide Formula: C26H18FN3O3S2 MolecularWeight: 503.567823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC(=C(C=C2C#N)NS(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC(=C(C=C2C#N)NS(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H18FN3O3S2/c27-21-13-11-19(12-14-21)25-23(30-35(32,33)22-9-5-2-6-10-22)15-20(16-28)26(29-25)34-17-24(31)18-7-3-1-4-8-18/h1-15,30H,17H2