methyl 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoranyl-ethanoate

Systemtic Name: methyl 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoranyl-ethanoate Openeye Name: methyl 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoro-acetate CAS Name: 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylthio]phenoxy]-2-fluoroacetic acid methyl ester IUPAC Name: methyl 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoroacetate Traditional Name: 2-[4-[2-(brosylamino)ethylthio]phenoxy]-2-fluoro-acetic acid methyl ester Formula: C17H17BrFNO5S2 MolecularWeight: 478.352983

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(OC1=CC=C(C=C1)SCCNS(=O)(=O)C2=CC=C(C=C2)Br)F

Isomeric SMILES

COC(=O)C(OC1=CC=C(C=C1)SCCNS(=O)(=O)C2=CC=C(C=C2)Br)F

InChI

InChI=1S/C17H17BrFNO5S2/c1-24-17(21)16(19)25-13-4-6-14(7-5-13)26-11-10-20-27(22,23)15-8-2-12(18)3-9-15/h2-9,16,20H,10-11H2,1H3