methyl 4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(5-bromo-6-chloropyridin-3-yl)sulfonyl-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C12H9BrClNO4S3 MolecularWeight: 442.75616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9BrClNO4S3/c1-19-11(16)8-4-9(12(20-2)21-8)22(17,18)6-3-7(13)10(14)15-5-6/h3-5H,1-2H3