(1S,2R)-2-[(4-chlorophenyl)sulfonyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]amino]cyclohexane-1-carboxamide

Systemtic Name: (1S,2R)-2-[(4-chlorophenyl)sulfonyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]amino]cyclohexane-1-carboxamide Openeye Name: (1S,2R)-2-[(4-chlorophenyl)sulfonyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]amino]cyclohexanecarboxamide CAS Name: (1S,2R)-2-[(4-chlorophenyl)sulfonyl-[[4-(trifluoromethylthio)phenyl]methyl]amino]-1-cyclohexanecarboxamide IUPAC Name: (1S,2R)-2-[(4-chlorophenyl)sulfonyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]amino]cyclohexane-1-carboxamide Traditional Name: (1S,2R)-2-[(4-chlorophenyl)sulfonyl-[4-(trifluoromethylthio)benzyl]amino]cyclohexanecarboxamide Formula: C21H22ClF3N2O3S2 MolecularWeight: 506.98919

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)N)N(CC2=CC=C(C=C2)SC(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)N)N(CC2=CC=C(C=C2)SC(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClF3N2O3S2/c22-15-7-11-17(12-8-15)32(29,30)27(19-4-2-1-3-18(19)20(26)28)13-14-5-9-16(10-6-14)31-21(23,24)25/h5-12,18-19H,1-4,13H2,(H2,26,28)/t18-,19+/m0/s1