6-chloranyl-3-methoxy-5-methylsulfanyl-pyrazine-2-carboxylic acid

Systemtic Name: 6-chloranyl-3-methoxy-5-methylsulfanyl-pyrazine-2-carboxylic acid Openeye Name: 6-chloro-3-methoxy-5-methylsulfanyl-pyrazine-2-carboxylic acid CAS Name: 6-chloro-3-methoxy-5-(methylthio)-2-pyrazinecarboxylic acid IUPAC Name: 6-chloro-3-methoxy-5-methylsulfanylpyrazine-2-carboxylic acid Traditional Name: 6-chloro-3-methoxy-5-(methylthio)pyrazinoic acid Formula: C7H7ClN2O3S MolecularWeight: 234.66008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=C(C(=N1)SC)Cl)C(=O)O

Isomeric SMILES

COC1=C(N=C(C(=N1)SC)Cl)C(=O)O

InChI

InChI=1S/C7H7ClN2O3S/c1-13-5-3(7(11)12)9-4(8)6(10-5)14-2/h1-2H3,(H,11,12)