1-methyl-4-[(3-methylsulfanylphenyl)sulfamoyl]pyrrole-2-carboxylate

Systemtic Name: 1-methyl-4-[(3-methylsulfanylphenyl)sulfamoyl]pyrrole-2-carboxylate Openeye Name: 1-methyl-4-[(3-methylsulfanylphenyl)sulfamoyl]pyrrole-2-carboxylate CAS Name: 1-methyl-4-[[3-(methylthio)phenyl]sulfamoyl]-2-pyrrolecarboxylate IUPAC Name: 1-methyl-4-[(3-methylsulfanylphenyl)sulfamoyl]pyrrole-2-carboxylate Traditional Name: 1-methyl-4-[[3-(methylthio)phenyl]sulfamoyl]pyrrole-2-carboxylate Formula: C13H13N2O4S2- MolecularWeight: 325.38332

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)NC2=CC(=CC=C2)SC

Isomeric SMILES

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C13H14N2O4S2/c1-15-8-11(7-12(15)13(16)17)21(18,19)14-9-4-3-5-10(6-9)20-2/h3-8,14H,1-2H3,(H,16,17)/p-1