6-(2-bromophenyl)sulfanyl-5-chloranyl-pyridine-3-carboxylic acid

Systemtic Name: 6-(2-bromophenyl)sulfanyl-5-chloranyl-pyridine-3-carboxylic acid Openeye Name: 6-(2-bromophenyl)sulfanyl-5-chloro-pyridine-3-carboxylic acid CAS Name: 6-[(2-bromophenyl)thio]-5-chloro-3-pyridinecarboxylic acid IUPAC Name: 6-(2-bromophenyl)sulfanyl-5-chloropyridine-3-carboxylic acid Traditional Name: 6-[(2-bromophenyl)thio]-5-chloro-nicotinic acid Formula: C12H7BrClNO2S MolecularWeight: 344.61148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SC2=C(C=C(C=N2)C(=O)O)Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)SC2=C(C=C(C=N2)C(=O)O)Cl)Br

InChI

InChI=1S/C12H7BrClNO2S/c13-8-3-1-2-4-10(8)18-11-9(14)5-7(6-15-11)12(16)17/h1-6H,(H,16,17)