1-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-(4-methylsulfanylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-(4-methylsulfanylphenyl)piperidine-4-carboxamide Openeye Name: 1-(3,4-difluorophenyl)sulfonyl-N-(4-methylsulfanylphenyl)piperidine-4-carboxamide CAS Name: 1-(3,4-difluorophenyl)sulfonyl-N-[4-(methylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-difluorophenyl)sulfonyl-N-(4-methylsulfanylphenyl)piperidine-4-carboxamide Traditional Name: 1-(3,4-difluorophenyl)sulfonyl-N-[4-(methylthio)phenyl]isonipecotamide Formula: C19H20F2N2O3S2 MolecularWeight: 426.500506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C19H20F2N2O3S2/c1-27-15-4-2-14(3-5-15)22-19(24)13-8-10-23(11-9-13)28(25,26)16-6-7-17(20)18(21)12-16/h2-7,12-13H,8-11H2,1H3,(H,22,24)