3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-[[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C12H14N6O6S MolecularWeight: 370.34116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=NN(C=C2C(=O)O)C)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=NN(C=C2C(=O)O)C)OC

InChI

InChI=1S/C12H14N6O6S/c1-6-4-8(24-3)14-11(13-6)15-12(21)17-25(22,23)9-7(10(19)20)5-18(2)16-9/h4-5H,1-3H3,(H,19,20)(H2,13,14,15,17,21)