2-(2-fluorophenyl)sulfanyl-N-[[3-(methylsulfonylamino)phenyl]methyl]-5-nitro-benzamide

Systemtic Name: 2-(2-fluorophenyl)sulfanyl-N-[[3-(methylsulfonylamino)phenyl]methyl]-5-nitro-benzamide Openeye Name: 2-(2-fluorophenyl)sulfanyl-N-[[3-(methanesulfonamido)phenyl]methyl]-5-nitro-benzamide CAS Name: 2-[(2-fluorophenyl)thio]-N-[[3-(methanesulfonamido)phenyl]methyl]-5-nitrobenzamide IUPAC Name: 2-(2-fluorophenyl)sulfanyl-N-[[3-(methanesulfonamido)phenyl]methyl]-5-nitrobenzamide Traditional Name: 2-[(2-fluorophenyl)thio]-N-[3-(methanesulfonamido)benzyl]-5-nitro-benzamide Formula: C21H18FN3O5S2 MolecularWeight: 475.513123

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F

InChI

InChI=1S/C21H18FN3O5S2/c1-32(29,30)24-15-6-4-5-14(11-15)13-23-21(26)17-12-16(25(27)28)9-10-19(17)31-20-8-3-2-7-18(20)22/h2-12,24H,13H2,1H3,(H,23,26)