5-[[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[5-(diethylsulfamoyl)-2,3-dimethylphenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[5-(diethylsulfamoyl)-2,3-dimethylphenyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]sulfamoyl]-3-thenoic acid Formula: C17H22N2O6S3 MolecularWeight: 446.56138

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C(=C1)C)C)NS(=O)(=O)C2=CC(=CS2)C(=O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C(=C1)C)C)NS(=O)(=O)C2=CC(=CS2)C(=O)O

InChI

InChI=1S/C17H22N2O6S3/c1-5-19(6-2)28(24,25)14-7-11(3)12(4)15(9-14)18-27(22,23)16-8-13(10-26-16)17(20)21/h7-10,18H,5-6H2,1-4H3,(H,20,21)