methyl 5-bromanyl-4-(4-methylpentylsulfamoyl)thiophene-2-carboxylate

Systemtic Name: methyl 5-bromanyl-4-(4-methylpentylsulfamoyl)thiophene-2-carboxylate Openeye Name: methyl 5-bromo-4-(isohexylsulfamoyl)thiophene-2-carboxylate CAS Name: 5-bromo-4-(4-methylpentylsulfamoyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-4-(4-methylpentylsulfamoyl)thiophene-2-carboxylate Traditional Name: 5-bromo-4-(isohexylsulfamoyl)thiophene-2-carboxylic acid methyl ester Formula: C12H18BrNO4S2 MolecularWeight: 384.30962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCNS(=O)(=O)C1=C(SC(=C1)C(=O)OC)Br

Isomeric SMILES

CC(C)CCCNS(=O)(=O)C1=C(SC(=C1)C(=O)OC)Br

InChI

InChI=1S/C12H18BrNO4S2/c1-8(2)5-4-6-14-20(16,17)10-7-9(12(15)18-3)19-11(10)13/h7-8,14H,4-6H2,1-3H3