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

Systemtic Name: 2-[4-bromanyl-2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamothioyl]phenoxy]ethanoic acid Openeye Name: 2-[4-bromo-2-[(4-bromo-2-fluoro-phenyl)methylcarbamothioyl]phenoxy]acetic acid CAS Name: 2-[4-bromo-2-[[(4-bromo-2-fluorophenyl)methylamino]-sulfanylidenemethyl]phenoxy]acetic acid IUPAC Name: 2-[4-bromo-2-[(4-bromo-2-fluorophenyl)methylcarbamothioyl]phenoxy]acetic acid Traditional Name: 2-[4-bromo-2-[(4-bromo-2-fluoro-benzyl)thiocarbamoyl]phenoxy]acetic acid Formula: C16H12Br2FNO3S MolecularWeight: 477.142783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)CNC(=S)C2=C(C=CC(=C2)Br)OCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)F)CNC(=S)C2=C(C=CC(=C2)Br)OCC(=O)O

InChI

InChI=1S/C16H12Br2FNO3S/c17-10-3-4-14(23-8-15(21)22)12(5-10)16(24)20-7-9-1-2-11(18)6-13(9)19/h1-6H,7-8H2,(H,20,24)(H,21,22)