N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-fluoranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-fluoranyl-3-nitro-benzenesulfonamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-fluoro-3-nitro-benzenesulfonamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-4-fluoro-3-nitrobenzenesulfonamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-fluoro-3-nitrobenzenesulfonamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-4-fluoro-3-nitro-benzenesulfonamide Formula: C15H14ClFN2O4S2 MolecularWeight: 404.864063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCCNS(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CSCCNS(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H14ClFN2O4S2/c16-12-3-1-11(2-4-12)10-24-8-7-18-25(22,23)13-5-6-14(17)15(9-13)19(20)21/h1-6,9,18H,7-8,10H2