N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(4-fluorobenzoyl)isonipecotamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O4S/c1-15-4-9-19(31(29,30)25(2)3)14-20(15)24-21(27)16-10-12-26(13-11-16)22(28)17-5-7-18(23)8-6-17/h4-9,14,16H,10-13H2,1-3H3,(H,24,27)