methyl 3-iodanyl-5-methylsulfanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-iodanyl-5-methylsulfanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate Openeye Name: methyl 3-iodo-4-isopropylsulfonyl-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-iodo-5-(methylthio)-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-iodo-5-methylsulfanyl-4-propan-2-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-iodo-4-isopropylsulfonyl-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C10H13IO4S3 MolecularWeight: 420.30729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(SC(=C1I)C(=O)OC)SC

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(SC(=C1I)C(=O)OC)SC

InChI

InChI=1S/C10H13IO4S3/c1-5(2)18(13,14)8-6(11)7(9(12)15-3)17-10(8)16-4/h5H,1-4H3