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

Systemtic Name: 2-[propan-2-ylsulfanylmethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide Openeye Name: 2-[isopropylsulfanylmethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]thioacetamide CAS Name: 2-[(propan-2-ylthio)methyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide IUPAC Name: 2-[propan-2-ylsulfanylmethyl-[[2-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide Traditional Name: 2-[(isopropylthio)methyl-[2-(trifluoromethyl)benzyl]sulfonyl-amino]thioacetamide Formula: C14H19F3N2O2S3 MolecularWeight: 400.50307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCN(CC(=S)N)S(=O)(=O)CC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CC(C)SCN(CC(=S)N)S(=O)(=O)CC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C14H19F3N2O2S3/c1-10(2)23-9-19(7-13(18)22)24(20,21)8-11-5-3-4-6-12(11)14(15,16)17/h3-6,10H,7-9H2,1-2H3,(H2,18,22)