N4-[2-[bis(fluoranyl)methylsulfanyl]phenyl]benzene-1,4-disulfonamide

Systemtic Name: N4-[2-[bis(fluoranyl)methylsulfanyl]phenyl]benzene-1,4-disulfonamide Openeye Name: N4-[2-(difluoromethylsulfanyl)phenyl]benzene-1,4-disulfonamide CAS Name: N4-[2-(difluoromethylthio)phenyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-[2-(difluoromethylsulfanyl)phenyl]benzene-1,4-disulfonamide Traditional Name: N'-[2-(difluoromethylthio)phenyl]benzene-1,4-disulfonamide Formula: C13H12F2N2O4S3 MolecularWeight: 394.437186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)SC(F)F

Isomeric SMILES

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)SC(F)F

InChI

InChI=1S/C13H12F2N2O4S3/c14-13(15)22-12-4-2-1-3-11(12)17-24(20,21)10-7-5-9(6-8-10)23(16,18)19/h1-8,13,17H,(H2,16,18,19)