N-[3-(dimethylsulfamoyl)phenyl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide

Systemtic Name: N-[3-(dimethylsulfamoyl)phenyl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-[3-(dimethylsulfamoyl)phenyl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide CAS Name: N-[3-(dimethylsulfamoyl)phenyl]-4-[(4-fluorophenyl)thio]-3-nitrobenzamide IUPAC Name: N-[3-(dimethylsulfamoyl)phenyl]-4-(4-fluorophenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-[3-(dimethylsulfamoyl)phenyl]-4-[(4-fluorophenyl)thio]-3-nitro-benzamide Formula: C21H18FN3O5S2 MolecularWeight: 475.513123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18FN3O5S2/c1-24(2)32(29,30)18-5-3-4-16(13-18)23-21(26)14-6-11-20(19(12-14)25(27)28)31-17-9-7-15(22)8-10-17/h3-13H,1-2H3,(H,23,26)