methyl 4-(2-bromanylethanoyl)-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-(2-bromanylethanoyl)-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 4-(2-bromoacetyl)-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-(2-bromo-1-oxoethyl)-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-bromoacetyl)-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-(2-bromoacetyl)-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C9H9BrO3S2 MolecularWeight: 309.19996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C(=O)CBr

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C(=O)CBr

InChI

InChI=1S/C9H9BrO3S2/c1-13-8(12)7-3-5(6(11)4-10)9(14-2)15-7/h3H,4H2,1-2H3