[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 5-sulfamoylthiophene-3-carboxylate

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 5-sulfamoylthiophene-3-carboxylate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] 5-sulfamoylthiophene-3-carboxylate CAS Name: 5-sulfamoyl-3-thiophenecarboxylic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 5-sulfamoylthiophene-3-carboxylate Traditional Name: 5-sulfamoylthiophene-3-carboxylic acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C13H10N4O5S3 MolecularWeight: 398.4373

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)NC(=O)COC(=O)C3=CSC(=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)NC(=O)COC(=O)C3=CSC(=C3)S(=O)(=O)N

InChI

InChI=1S/C13H10N4O5S3/c14-25(20,21)11-4-7(6-23-11)13(19)22-5-10(18)15-8-2-1-3-9-12(8)17-24-16-9/h1-4,6H,5H2,(H,15,18)(H2,14,20,21)