2-(5-bromanylpyridin-2-yl)sulfanylpyridine-3-carboxylate

Systemtic Name: 2-(5-bromanylpyridin-2-yl)sulfanylpyridine-3-carboxylate Openeye Name: 2-[(5-bromo-2-pyridyl)sulfanyl]pyridine-3-carboxylate CAS Name: 2-[(5-bromo-2-pyridinyl)thio]-3-pyridinecarboxylate IUPAC Name: 2-(5-bromopyridin-2-yl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(5-bromo-2-pyridyl)thio]nicotinate Formula: C11H6BrN2O2S- MolecularWeight: 310.14654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7BrN2O2S/c12-7-3-4-9(14-6-7)17-10-8(11(15)16)2-1-5-13-10/h1-6H,(H,15,16)/p-1