4-(4-fluorophenyl)sulfonyl-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(4-fluorophenyl)sulfonyl-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-(4-fluorophenyl)sulfonyl-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]-1,4-diazepane-1-carboxamide CAS Name: 4-(4-fluorophenyl)sulfonyl-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(4-fluorophenyl)sulfonyl-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-(4-fluorophenyl)sulfonyl-N-[2-(methylsulfamoylmethyl)benzyl]-1,4-diazepane-1-carboxamide Formula: C21H27FN4O5S2 MolecularWeight: 498.591283

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)CC1=CC=CC=C1CNC(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CNS(=O)(=O)CC1=CC=CC=C1CNC(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H27FN4O5S2/c1-23-32(28,29)16-18-6-3-2-5-17(18)15-24-21(27)25-11-4-12-26(14-13-25)33(30,31)20-9-7-19(22)8-10-20/h2-3,5-10,23H,4,11-16H2,1H3,(H,24,27)