N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]pyrrolidine-1-carbothioamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]pyrrolidine-1-carbothioamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]pyrrolidine-1-carbothioamide CAS Name: N-[4-(difluoromethylthio)phenyl]-1-pyrrolidinecarbothioamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]pyrrolidine-1-carbothioamide Traditional Name: N-[4-(difluoromethylthio)phenyl]pyrrolidine-1-carbothioamide Formula: C12H14F2N2S2 MolecularWeight: 288.379766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC2=CC=C(C=C2)SC(F)F

Isomeric SMILES

C1CCN(C1)C(=S)NC2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C12H14F2N2S2/c13-11(14)18-10-5-3-9(4-6-10)15-12(17)16-7-1-2-8-16/h3-6,11H,1-2,7-8H2,(H,15,17)