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The molecular formula is C5H5BrN2O2S.
The synonyms are Methyl 2-amino-5-bromothiazole-4-carboxylate, 850429-60-6, methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate, 2-Amino-5-bromothiazole-4-carboxylic acid methyl ester, MFCD00137990.
The molecular weight is 237.08 g/mol.
The IUPAC name is methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate.
The InChI is InChI=1S/C5H5BrN2O2S/c1-10-4(9)2-3(6)11-5(7)8-2/h1H3,(H2,7,8).
The InChIKey is KVUHCAXYWHQFLW-UHFFFAOYSA-N.
The canonical SMILES is COC(=O)C1=C(SC(=N1)N)Br.
The CAS number is 850429-60-6.
The European Community (EC) number is 690-838-9.
Yes, it is a canonicalized compound.
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