N-[2,5-bis(fluoranyl)phenyl]-4-chloranyl-N-[[2-[3-(4-methoxyphenyl)sulfanylpropoxy]phenyl]methyl]benzenesulfonamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-4-chloranyl-N-[[2-[3-(4-methoxyphenyl)sulfanylpropoxy]phenyl]methyl]benzenesulfonamide Openeye Name: 4-chloro-N-(2,5-difluorophenyl)-N-[[2-[3-(4-methoxyphenyl)sulfanylpropoxy]phenyl]methyl]benzenesulfonamide CAS Name: 4-chloro-N-(2,5-difluorophenyl)-N-[[2-[3-[(4-methoxyphenyl)thio]propoxy]phenyl]methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2,5-difluorophenyl)-N-[[2-[3-(4-methoxyphenyl)sulfanylpropoxy]phenyl]methyl]benzenesulfonamide Traditional Name: 4-chloro-N-(2,5-difluorophenyl)-N-[2-[3-[(4-methoxyphenyl)thio]propoxy]benzyl]benzenesulfonamide Formula: C29H26ClF2NO4S2 MolecularWeight: 590.100846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCCOC2=CC=CC=C2CN(C3=C(C=CC(=C3)F)F)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)SCCCOC2=CC=CC=C2CN(C3=C(C=CC(=C3)F)F)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H26ClF2NO4S2/c1-36-24-10-12-25(13-11-24)38-18-4-17-37-29-6-3-2-5-21(29)20-33(28-19-23(31)9-16-27(28)32)39(34,35)26-14-7-22(30)8-15-26/h2-3,5-16,19H,4,17-18,20H2,1H3