5-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[4-(2-ketopyrrolidino)-3-methyl-phenyl]sulfamoyl]-3-thenoic acid Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC(=CS2)C(=O)O)N3CCCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC(=CS2)C(=O)O)N3CCCC3=O

InChI

InChI=1S/C16H16N2O5S2/c1-10-7-12(4-5-13(10)18-6-2-3-14(18)19)17-25(22,23)15-8-11(9-24-15)16(20)21/h4-5,7-9,17H,2-3,6H2,1H3,(H,20,21)