2-(5-bromanylpyridin-2-yl)sulfanylbenzoate

Systemtic Name: 2-(5-bromanylpyridin-2-yl)sulfanylbenzoate Openeye Name: 2-[(5-bromo-2-pyridyl)sulfanyl]benzoate CAS Name: 2-[(5-bromo-2-pyridinyl)thio]benzoate IUPAC Name: 2-(5-bromopyridin-2-yl)sulfanylbenzoate Traditional Name: 2-[(5-bromo-2-pyridyl)thio]benzoate Formula: C12H7BrNO2S- MolecularWeight: 309.15848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])SC2=NC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])SC2=NC=C(C=C2)Br

InChI

InChI=1S/C12H8BrNO2S/c13-8-5-6-11(14-7-8)17-10-4-2-1-3-9(10)12(15)16/h1-7H,(H,15,16)/p-1