2-[(5-bromanylthiophen-2-yl)methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(5-bromanylthiophen-2-yl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[(5-bromo-2-thienyl)methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[(5-bromo-2-thiophenyl)methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(5-bromothiophen-2-yl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[(5-bromo-2-thienyl)methylthio]nicotinic acid Formula: C11H8BrNO2S2 MolecularWeight: 330.22072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC=C(S2)Br)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC=C(S2)Br)C(=O)O

InChI

InChI=1S/C11H8BrNO2S2/c12-9-4-3-7(17-9)6-16-10-8(11(14)15)2-1-5-13-10/h1-5H,6H2,(H,14,15)