methyl 3-[(4-sulfamoylphenyl)methylsulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-sulfamoylphenyl)methylsulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(4-sulfamoylphenyl)methylsulfamoyl]thiophene-2-carboxylate CAS Name: 3-[(4-sulfamoylphenyl)methylsulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-sulfamoylphenyl)methylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(4-sulfamoylbenzyl)sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C13H14N2O6S3 MolecularWeight: 390.45506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C13H14N2O6S3/c1-21-13(16)12-11(6-7-22-12)24(19,20)15-8-9-2-4-10(5-3-9)23(14,17)18/h2-7,15H,8H2,1H3,(H2,14,17,18)