5-bromanyl-2-methylsulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 5-bromanyl-2-methylsulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 5-bromo-2-methylsulfanyl-pyrimidine-4-carboxylic acid CAS Name: 5-bromo-2-(methylthio)-4-pyrimidinecarboxylic acid IUPAC Name: 5-bromo-2-methylsulfanylpyrimidine-4-carboxylic acid Traditional Name: 5-bromo-2-(methylthio)pyrimidine-4-carboxylic acid Formula: C6H5BrN2O2S MolecularWeight: 249.0851

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)O)Br

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)O)Br

InChI

InChI=1S/C6H5BrN2O2S/c1-12-6-8-2-3(7)4(9-6)5(10)11/h2H,1H3,(H,10,11)