N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(3-acetylphenyl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(3-acetylphenyl)sulfonyl-N-[2-(difluoromethylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-acetylphenyl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-acetylphenyl)sulfonyl-N-[2-(difluoromethylthio)phenyl]isonipecotamide Formula: C21H22F2N2O4S2 MolecularWeight: 468.537186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3SC(F)F

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3SC(F)F

InChI

InChI=1S/C21H22F2N2O4S2/c1-14(26)16-5-4-6-17(13-16)31(28,29)25-11-9-15(10-12-25)20(27)24-18-7-2-3-8-19(18)30-21(22)23/h2-8,13,15,21H,9-12H2,1H3,(H,24,27)