2-[[2-chloranyl-4-(trifluoromethyl)phenyl]methylsulfonyl-(propan-2-ylsulfanylmethyl)amino]ethanethioamide

Systemtic Name: 2-[[2-chloranyl-4-(trifluoromethyl)phenyl]methylsulfonyl-(propan-2-ylsulfanylmethyl)amino]ethanethioamide Openeye Name: 2-[[2-chloro-4-(trifluoromethyl)phenyl]methylsulfonyl-(isopropylsulfanylmethyl)amino]thioacetamide CAS Name: 2-[[2-chloro-4-(trifluoromethyl)phenyl]methylsulfonyl-[(propan-2-ylthio)methyl]amino]ethanethioamide IUPAC Name: 2-[[2-chloro-4-(trifluoromethyl)phenyl]methylsulfonyl-(propan-2-ylsulfanylmethyl)amino]ethanethioamide Traditional Name: 2-[[2-chloro-4-(trifluoromethyl)benzyl]sulfonyl-[(isopropylthio)methyl]amino]thioacetamide Formula: C14H18ClF3N2O2S3 MolecularWeight: 434.94813

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCN(CC(=S)N)S(=O)(=O)CC1=C(C=C(C=C1)C(F)(F)F)Cl

Isomeric SMILES

CC(C)SCN(CC(=S)N)S(=O)(=O)CC1=C(C=C(C=C1)C(F)(F)F)Cl

InChI

InChI=1S/C14H18ClF3N2O2S3/c1-9(2)24-8-20(6-13(19)23)25(21,22)7-10-3-4-11(5-12(10)15)14(16,17)18/h3-5,9H,6-8H2,1-2H3,(H2,19,23)