2-[cyanomethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide

Systemtic Name: 2-[cyanomethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide Openeye Name: 2-[cyanomethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]thioacetamide CAS Name: 2-[cyanomethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide IUPAC Name: 2-[cyanomethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide Traditional Name: 2-[cyanomethyl-[2-(trifluoromethyl)benzyl]sulfonyl-amino]thioacetamide Formula: C12H12F3N3O2S2 MolecularWeight: 351.36779

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CS(=O)(=O)N(CC#N)CC(=S)N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CS(=O)(=O)N(CC#N)CC(=S)N)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O2S2/c13-12(14,15)10-4-2-1-3-9(10)8-22(19,20)18(6-5-16)7-11(17)21/h1-4H,6-8H2,(H2,17,21)