4-[(4-methylsulfanylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: 4-[(4-methylsulfanylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylate Openeye Name: 4-[(4-methylsulfanylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylate CAS Name: 4-[[4-(methylthio)phenyl]sulfamoyl]-1H-pyrrole-2-carboxylate IUPAC Name: 4-[(4-methylsulfanylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[[4-(methylthio)phenyl]sulfamoyl]-1H-pyrrole-2-carboxylate Formula: C12H11N2O4S2- MolecularWeight: 311.35674

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NS(=O)(=O)C2=CNC(=C2)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)NS(=O)(=O)C2=CNC(=C2)C(=O)[O-]

InChI

InChI=1S/C12H12N2O4S2/c1-19-9-4-2-8(3-5-9)14-20(17,18)10-6-11(12(15)16)13-7-10/h2-7,13-14H,1H3,(H,15,16)/p-1