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

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-[2-(difluoromethylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(4-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=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3SC(F)F

Isomeric SMILES

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

InChI

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