4-(2-bromanyl-5-fluoranyl-phenyl)sulfanyl-N,N-dimethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2-bromanyl-5-fluoranyl-phenyl)sulfanyl-N,N-dimethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(2-bromo-5-fluoro-phenyl)sulfanyl-N,N-dimethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(2-bromo-5-fluorophenyl)thio]-N,N-dimethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(2-bromo-5-fluorophenyl)sulfanyl-N,N-dimethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(2-bromo-5-fluoro-phenyl)thio]-N,N-dimethyl-3-nitro-benzenesulfonamide Formula: C14H12BrFN2O4S2 MolecularWeight: 435.288483

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)SC2=C(C=CC(=C2)F)Br)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)SC2=C(C=CC(=C2)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H12BrFN2O4S2/c1-17(2)24(21,22)10-4-6-13(12(8-10)18(19)20)23-14-7-9(16)3-5-11(14)15/h3-8H,1-2H3