1-[(4-fluorophenyl)-methyl-sulfamoyl]-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-[(4-fluorophenyl)-methyl-sulfamoyl]-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-[(4-fluorophenyl)-methyl-sulfamoyl]-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-[(4-fluorophenyl)-methylsulfamoyl]-N-[[4-(methylthio)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-[(4-fluorophenyl)-methylsulfamoyl]-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-[(4-fluorophenyl)-methyl-sulfamoyl]-N-[4-(methylthio)benzyl]nipecotamide Formula: C21H26FN3O3S2 MolecularWeight: 451.577843

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)F)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)SC

Isomeric SMILES

CN(C1=CC=C(C=C1)F)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H26FN3O3S2/c1-24(19-9-7-18(22)8-10-19)30(27,28)25-13-3-4-17(15-25)21(26)23-14-16-5-11-20(29-2)12-6-16/h5-12,17H,3-4,13-15H2,1-2H3,(H,23,26)