4-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-1H-pyrrole-2-carboxylic acid Formula: C12H13N5O5S MolecularWeight: 339.32712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CNC(=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CNC(=C2)C(=O)O)C

InChI

InChI=1S/C12H13N5O5S/c1-6-3-7(2)15-11(14-6)16-12(20)17-23(21,22)8-4-9(10(18)19)13-5-8/h3-5,13H,1-2H3,(H,18,19)(H2,14,15,16,17,20)