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

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(4-ethoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-1-(4-ethoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(difluoromethylthio)phenyl]-1-(4-ethoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-1-p-phenetylsulfonyl-isonipecotamide Formula: C21H24F2N2O4S2 MolecularWeight: 470.553066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C21H24F2N2O4S2/c1-2-29-17-5-9-19(10-6-17)31(27,28)25-13-11-15(12-14-25)20(26)24-16-3-7-18(8-4-16)30-21(22)23/h3-10,15,21H,2,11-14H2,1H3,(H,24,26)