methyl N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboximidothioate iodide

Systemtic Name: methyl N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboximidothioate iodide Openeye Name: methyl N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboximidothioate iodide CAS Name: N-[2-(trifluoromethyl)phenyl]-1-pyrrolidinecarboximidothioic acid methyl ester iodide IUPAC Name: methyl N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboximidothioate iodide Traditional Name: N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboximidothioic acid methyl ester iodide Formula: C13H15F3IN2S- MolecularWeight: 415.23628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=CC=C1C(F)(F)F)N2CCCC2.[I-]

Isomeric SMILES

CSC(=NC1=CC=CC=C1C(F)(F)F)N2CCCC2.[I-]

InChI

InChI=1S/C13H15F3N2S.HI/c1-19-12(18-8-4-5-9-18)17-11-7-3-2-6-10(11)13(14,15)16;/h2-3,6-7H,4-5,8-9H2,1H3;1H/p-1