4-[bis(4-fluorophenyl)methylsulfanyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[bis(4-fluorophenyl)methylsulfanyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[bis(4-fluorophenyl)methylsulfanyl]-3-nitro-benzenesulfonamide CAS Name: 4-[bis(4-fluorophenyl)methylthio]-3-nitrobenzenesulfonamide IUPAC Name: 4-[bis(4-fluorophenyl)methylsulfanyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[bis(4-fluorophenyl)methylthio]-3-nitro-benzenesulfonamide Formula: C19H14F2N2O4S2 MolecularWeight: 436.452266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=CC=C(C=C2)F)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)F)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-])F

InChI

InChI=1S/C19H14F2N2O4S2/c20-14-5-1-12(2-6-14)19(13-3-7-15(21)8-4-13)28-18-10-9-16(29(22,26)27)11-17(18)23(24)25/h1-11,19H,(H2,22,26,27)