N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C18H21ClFNO2S2 MolecularWeight: 401.946243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCSCC2=C(C=CC=C2Cl)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCSCC2=C(C=CC=C2Cl)F)C

InChI

InChI=1S/C18H21ClFNO2S2/c1-12-9-13(2)18(14(3)10-12)25(22,23)21-7-8-24-11-15-16(19)5-4-6-17(15)20/h4-6,9-10,21H,7-8,11H2,1-3H3