N4-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzene-1,4-disulfonamide

Systemtic Name: N4-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzene-1,4-disulfonamide Openeye Name: N4-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzene-1,4-disulfonamide CAS Name: N4-[2-[(2-fluorophenyl)methylthio]ethyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzene-1,4-disulfonamide Traditional Name: N'-[2-[(2-fluorobenzyl)thio]ethyl]benzene-1,4-disulfonamide Formula: C15H17FN2O4S3 MolecularWeight: 404.499883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)F

InChI

InChI=1S/C15H17FN2O4S3/c16-15-4-2-1-3-12(15)11-23-10-9-18-25(21,22)14-7-5-13(6-8-14)24(17,19)20/h1-8,18H,9-11H2,(H2,17,19,20)