N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-4-methoxy-3-methyl-benzenesulfonamide

Systemtic Name: N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-4-methoxy-3-methyl-benzenesulfonamide Openeye Name: N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-4-methoxy-3-methyl-benzenesulfonamide CAS Name: N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-4-methoxy-3-methylbenzenesulfonamide IUPAC Name: N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-methoxy-3-methylbenzenesulfonamide Traditional Name: N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-4-methoxy-3-methyl-benzenesulfonamide Formula: C17H19ClFNO3S2 MolecularWeight: 403.919063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClFNO3S2/c1-12-10-13(6-7-17(12)23-2)25(21,22)20-8-9-24-11-14-15(18)4-3-5-16(14)19/h3-7,10,20H,8-9,11H2,1-2H3