2-[hexylsulfanylmethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanamide

Systemtic Name: 2-[hexylsulfanylmethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanamide Openeye Name: 2-[hexylsulfanylmethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]acetamide CAS Name: 2-[(hexylthio)methyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]acetamide IUPAC Name: 2-[hexylsulfanylmethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]acetamide Traditional Name: 2-[(hexylthio)methyl-[2-(trifluoromethyl)benzyl]sulfonyl-amino]acetamide Formula: C17H25F3N2O3S2 MolecularWeight: 426.51721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCN(CC(=O)N)S(=O)(=O)CC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CCCCCCSCN(CC(=O)N)S(=O)(=O)CC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C17H25F3N2O3S2/c1-2-3-4-7-10-26-13-22(11-16(21)23)27(24,25)12-14-8-5-6-9-15(14)17(18,19)20/h5-6,8-9H,2-4,7,10-13H2,1H3,(H2,21,23)