methyl 4-(5-bromanylpyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-(5-bromanylpyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 4-[(5-bromo-3-pyridyl)sulfonyl]-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-[(5-bromo-3-pyridinyl)sulfonyl]-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(5-bromopyridin-3-yl)sulfonyl-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-[(5-bromo-3-pyridyl)sulfonyl]-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C12H10BrNO4S3 MolecularWeight: 408.3111

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)S(=O)(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)S(=O)(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H10BrNO4S3/c1-18-11(15)9-4-10(12(19-2)20-9)21(16,17)8-3-7(13)5-14-6-8/h3-6H,1-2H3