methyl 2,6-bis(bromanyl)-1,3-benzothiazole-4-carboxylate

Systemtic Name: methyl 2,6-bis(bromanyl)-1,3-benzothiazole-4-carboxylate Openeye Name: methyl 2,6-dibromo-1,3-benzothiazole-4-carboxylate CAS Name: 2,6-dibromo-1,3-benzothiazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2,6-dibromo-1,3-benzothiazole-4-carboxylate Traditional Name: 2,6-dibromo-1,3-benzothiazole-4-carboxylic acid methyl ester Formula: C9H5Br2NO2S MolecularWeight: 351.0145

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC2=C1N=C(S2)Br)Br

Isomeric SMILES

COC(=O)C1=CC(=CC2=C1N=C(S2)Br)Br

InChI

InChI=1S/C9H5Br2NO2S/c1-14-8(13)5-2-4(10)3-6-7(5)12-9(11)15-6/h2-3H,1H3