3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid Openeye Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid CAS Name: 3-[[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid Traditional Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-2-thenoic acid Formula: C12H12N4O6S2 MolecularWeight: 372.37688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O)OC

InChI

InChI=1S/C12H12N4O6S2/c1-6-5-8(22-2)14-11(13-6)15-12(19)16-24(20,21)7-3-4-23-9(7)10(17)18/h3-5H,1-2H3,(H,17,18)(H2,13,14,15,16,19)