4-(5-bromanylpyridin-2-yl)sulfanylbenzoic acid

Systemtic Name: 4-(5-bromanylpyridin-2-yl)sulfanylbenzoic acid Openeye Name: 4-[(5-bromo-2-pyridyl)sulfanyl]benzoic acid CAS Name: 4-[(5-bromo-2-pyridinyl)thio]benzoic acid IUPAC Name: 4-(5-bromopyridin-2-yl)sulfanylbenzoic acid Traditional Name: 4-[(5-bromo-2-pyridyl)thio]benzoic acid Formula: C12H8BrNO2S MolecularWeight: 310.16642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SC2=NC=C(C=C2)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SC2=NC=C(C=C2)Br

InChI

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