1-(4-methylsulfanylphenyl)sulfonyl-N-[2-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylsulfanylphenyl)sulfonyl-N-[2-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(4-methylsulfanylphenyl)sulfonyl-N-[2-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[4-(methylthio)phenyl]sulfonyl-N-[2-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylsulfanylphenyl)sulfonyl-N-[2-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-[4-(methylthio)phenyl]sulfonyl-N-[2-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H21F3N2O3S2 MolecularWeight: 458.51755

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H21F3N2O3S2/c1-29-15-6-8-16(9-7-15)30(27,28)25-12-10-14(11-13-25)19(26)24-18-5-3-2-4-17(18)20(21,22)23/h2-9,14H,10-13H2,1H3,(H,24,26)