1-ethyl-4-[[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]pyrrole-2-carboxylic acid

Systemtic Name: 1-ethyl-4-[[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]pyrrole-2-carboxylic acid Openeye Name: 1-ethyl-4-[[2-(ethylamino)-1-methyl-2-oxo-ethyl]sulfamoyl]pyrrole-2-carboxylic acid CAS Name: 1-ethyl-4-[[1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]-2-pyrrolecarboxylic acid IUPAC Name: 1-ethyl-4-[[1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]pyrrole-2-carboxylic acid Traditional Name: 1-ethyl-4-[[2-(ethylamino)-2-keto-1-methyl-ethyl]sulfamoyl]pyrrole-2-carboxylic acid Formula: C12H19N3O5S MolecularWeight: 317.36136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NS(=O)(=O)C1=CN(C(=C1)C(=O)O)CC

Isomeric SMILES

CCNC(=O)C(C)NS(=O)(=O)C1=CN(C(=C1)C(=O)O)CC

InChI

InChI=1S/C12H19N3O5S/c1-4-13-11(16)8(3)14-21(19,20)9-6-10(12(17)18)15(5-2)7-9/h6-8,14H,4-5H2,1-3H3,(H,13,16)(H,17,18)