(2,4-dimethylphenyl) 3-[(4-bromanyl-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-2-carboxylate

Systemtic Name: (2,4-dimethylphenyl) 3-[(4-bromanyl-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-2-carboxylate Openeye Name: (2,4-dimethylphenyl) 3-[(4-bromo-3-methyl-isoxazol-5-yl)sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[(4-bromo-3-methyl-5-isoxazolyl)sulfamoyl]-2-thiophenecarboxylic acid (2,4-dimethylphenyl) ester IUPAC Name: (2,4-dimethylphenyl) 3-[(4-bromo-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(4-bromo-3-methyl-isoxazol-5-yl)sulfamoyl]thiophene-2-carboxylic acid (2,4-dimethylphenyl) ester Formula: C17H15BrN2O5S2 MolecularWeight: 471.3454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=C(C=CS2)S(=O)(=O)NC3=C(C(=NO3)C)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=C(C=CS2)S(=O)(=O)NC3=C(C(=NO3)C)Br)C

InChI

InChI=1S/C17H15BrN2O5S2/c1-9-4-5-12(10(2)8-9)24-17(21)15-13(6-7-26-15)27(22,23)20-16-14(18)11(3)19-25-16/h4-8,20H,1-3H3