N-[2-[(4-chloranyl-2-fluoranyl-phenyl)methylsulfanyl]ethyl]-4-(2-methylbutan-2-ylsulfonylamino)cyclohexane-1-carboxamide

Systemtic Name: N-[2-[(4-chloranyl-2-fluoranyl-phenyl)methylsulfanyl]ethyl]-4-(2-methylbutan-2-ylsulfonylamino)cyclohexane-1-carboxamide Openeye Name: N-[2-[(4-chloro-2-fluoro-phenyl)methylsulfanyl]ethyl]-4-(1,1-dimethylpropylsulfonylamino)cyclohexanecarboxamide CAS Name: N-[2-[(4-chloro-2-fluorophenyl)methylthio]ethyl]-4-(2-methylbutan-2-ylsulfonylamino)-1-cyclohexanecarboxamide IUPAC Name: N-[2-[(4-chloro-2-fluorophenyl)methylsulfanyl]ethyl]-4-(2-methylbutan-2-ylsulfonylamino)cyclohexane-1-carboxamide Traditional Name: 4-(tert-amylsulfonylamino)-N-[2-[(4-chloro-2-fluoro-benzyl)thio]ethyl]cyclohexanecarboxamide Formula: C21H32ClFN2O3S2 MolecularWeight: 479.071783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NCCSCC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CCC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NCCSCC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C21H32ClFN2O3S2/c1-4-21(2,3)30(27,28)25-18-9-6-15(7-10-18)20(26)24-11-12-29-14-16-5-8-17(22)13-19(16)23/h5,8,13,15,18,25H,4,6-7,9-12,14H2,1-3H3,(H,24,26)