3-methyl-5-[[1-oxidanylidene-1-(propylamino)propan-2-yl]sulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[[1-oxidanylidene-1-(propylamino)propan-2-yl]sulfamoyl]thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[[1-methyl-2-oxo-2-(propylamino)ethyl]sulfamoyl]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[1-oxo-1-(propylamino)propan-2-yl]sulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[[1-oxo-1-(propylamino)propan-2-yl]sulfamoyl]thiophene-2-carboxylic acid Traditional Name: 5-[[2-keto-1-methyl-2-(propylamino)ethyl]sulfamoyl]-3-methyl-2-thenoic acid Formula: C12H18N2O5S2 MolecularWeight: 334.41172

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NS(=O)(=O)C1=CC(=C(S1)C(=O)O)C

Isomeric SMILES

CCCNC(=O)C(C)NS(=O)(=O)C1=CC(=C(S1)C(=O)O)C

InChI

InChI=1S/C12H18N2O5S2/c1-4-5-13-11(15)8(3)14-21(18,19)9-6-7(2)10(20-9)12(16)17/h6,8,14H,4-5H2,1-3H3,(H,13,15)(H,16,17)