4-fluoranyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide CAS Name: 4-fluoro-N-[4-[(1,4,5-triphenyl-2-imidazolyl)thio]butyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[4-[(1,4,5-triphenylimidazol-2-yl)thio]butyl]benzenesulfonamide Formula: C31H28FN3O2S2 MolecularWeight: 557.701323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCNS(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCNS(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H28FN3O2S2/c32-26-18-20-28(21-19-26)39(36,37)33-22-10-11-23-38-31-34-29(24-12-4-1-5-13-24)30(25-14-6-2-7-15-25)35(31)27-16-8-3-9-17-27/h1-9,12-21,33H,10-11,22-23H2