5-(bromomethyl)-3-methyl-2H-1,3,4-thiadiazole-2-carboxylic acid

Systemtic Name: 5-(bromomethyl)-3-methyl-2H-1,3,4-thiadiazole-2-carboxylic acid Openeye Name: 5-(bromomethyl)-3-methyl-2H-1,3,4-thiadiazole-2-carboxylic acid CAS Name: 5-(bromomethyl)-3-methyl-2H-1,3,4-thiadiazole-2-carboxylic acid IUPAC Name: 5-(bromomethyl)-3-methyl-2H-1,3,4-thiadiazole-2-carboxylic acid Traditional Name: 5-(bromomethyl)-3-methyl-2H-1,3,4-thiadiazole-2-carboxylic acid Formula: C5H7BrN2O2S MolecularWeight: 239.09028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(SC(=N1)CBr)C(=O)O

Isomeric SMILES

CN1C(SC(=N1)CBr)C(=O)O

InChI

InChI=1S/C5H7BrN2O2S/c1-8-4(5(9)10)11-3(2-6)7-8/h4H,2H2,1H3,(H,9,10)