3-fluoranyl-4-methyl-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-methyl-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide Openeye Name: N-(2-benzylsulfanylethyl)-3-fluoro-4-methyl-benzenesulfonamide CAS Name: 3-fluoro-4-methyl-N-[2-(phenylmethylthio)ethyl]benzenesulfonamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-fluoro-4-methylbenzenesulfonamide Traditional Name: N-[2-(benzylthio)ethyl]-3-fluoro-4-methyl-benzenesulfonamide Formula: C16H18FNO2S2 MolecularWeight: 339.448023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCSCC2=CC=CC=C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCSCC2=CC=CC=C2)F

InChI

InChI=1S/C16H18FNO2S2/c1-13-7-8-15(11-16(13)17)22(19,20)18-9-10-21-12-14-5-3-2-4-6-14/h2-8,11,18H,9-10,12H2,1H3