2-[2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamothioyl]-5-fluoranyl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamothioyl]-5-fluoranyl-phenoxy]ethanoic acid Openeye Name: 2-[2-[(4-bromo-2-fluoro-phenyl)methylcarbamothioyl]-5-fluoro-phenoxy]acetic acid CAS Name: 2-[2-[[(4-bromo-2-fluorophenyl)methylamino]-sulfanylidenemethyl]-5-fluorophenoxy]acetic acid IUPAC Name: 2-[2-[(4-bromo-2-fluorophenyl)methylcarbamothioyl]-5-fluorophenoxy]acetic acid Traditional Name: 2-[2-[(4-bromo-2-fluoro-benzyl)thiocarbamoyl]-5-fluoro-phenoxy]acetic acid Formula: C16H12BrF2NO3S MolecularWeight: 416.237186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)OCC(=O)O)C(=S)NCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=C(C=C1F)OCC(=O)O)C(=S)NCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H12BrF2NO3S/c17-10-2-1-9(13(19)5-10)7-20-16(24)12-4-3-11(18)6-14(12)23-8-15(21)22/h1-6H,7-8H2,(H,20,24)(H,21,22)