N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-1-(dimethylsulfamoyl)piperidine-3-carboxamide

Systemtic Name: N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-1-(dimethylsulfamoyl)piperidine-3-carboxamide Openeye Name: N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-1-(dimethylsulfamoyl)piperidine-3-carboxamide CAS Name: N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-1-(dimethylsulfamoyl)-3-piperidinecarboxamide IUPAC Name: N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-1-(dimethylsulfamoyl)piperidine-3-carboxamide Traditional Name: N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-1-(dimethylsulfamoyl)nipecotamide Formula: C17H25ClFN3O3S2 MolecularWeight: 437.980103

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCCC(C1)C(=O)NCCSCC2=C(C=CC=C2Cl)F

Isomeric SMILES

CN(C)S(=O)(=O)N1CCCC(C1)C(=O)NCCSCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C17H25ClFN3O3S2/c1-21(2)27(24,25)22-9-4-5-13(11-22)17(23)20-8-10-26-12-14-15(18)6-3-7-16(14)19/h3,6-7,13H,4-5,8-12H2,1-2H3,(H,20,23)