N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[[3-[dimethylamino(oxo)methyl]phenyl]methyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(dimethylcarbamoyl)benzyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O4S/c1-25(2)22(28)18-5-3-4-16(14-18)15-24-21(27)17-10-12-26(13-11-17)31(29,30)20-8-6-19(23)7-9-20/h3-9,14,17H,10-13,15H2,1-2H3,(H,24,27)