N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3,4-bis(fluoranyl)benzenesulfonamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3,4-bis(fluoranyl)benzenesulfonamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-3,4-difluoro-benzenesulfonamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-3,4-difluorobenzenesulfonamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-3,4-difluorobenzenesulfonamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-3,4-difluoro-benzenesulfonamide Formula: C13H12BrF2NO2S3 MolecularWeight: 428.335686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCCSCC2=CC=C(S2)Br)F)F

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCCSCC2=CC=C(S2)Br)F)F

InChI

InChI=1S/C13H12BrF2NO2S3/c14-13-4-1-9(21-13)8-20-6-5-17-22(18,19)10-2-3-11(15)12(16)7-10/h1-4,7,17H,5-6,8H2