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

Systemtic Name: 5-[[5-(diethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[5-(diethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[5-(diethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[5-(diethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[5-(diethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-3-thenoic acid Formula: C17H23N3O6S3 MolecularWeight: 461.57602

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC(=CS2)C(=O)O

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC(=CS2)C(=O)O

InChI

InChI=1S/C17H23N3O6S3/c1-4-18-14-8-7-13(29(25,26)20(5-2)6-3)10-15(14)19-28(23,24)16-9-12(11-27-16)17(21)22/h7-11,18-19H,4-6H2,1-3H3,(H,21,22)