1-(4-fluorophenyl)sulfonyl-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[2-methyl-5-(1-oxopropylamino)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-(2-methyl-5-propionamido-phenyl)isonipecotamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

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