2-chloranyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-4-carboxylic acid

Systemtic Name: 2-chloranyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-4-carboxylic acid Openeye Name: 2-chloro-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-4-carboxylic acid CAS Name: 2-chloro-6-(1H-1,2,4-triazol-5-ylthio)-4-pyridinecarboxylic acid IUPAC Name: 2-chloro-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-4-carboxylic acid Traditional Name: 2-chloro-6-(1H-1,2,4-triazol-5-ylthio)isonicotinic acid Formula: C8H5ClN4O2S MolecularWeight: 256.6689

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(N=C1SC2=NC=NN2)Cl)C(=O)O

Isomeric SMILES

C1=C(C=C(N=C1SC2=NC=NN2)Cl)C(=O)O

InChI

InChI=1S/C8H5ClN4O2S/c9-5-1-4(7(14)15)2-6(12-5)16-8-10-3-11-13-8/h1-3H,(H,14,15)(H,10,11,13)