6-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-6-methyl-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-6-methylcyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid Formula: C15H18N4O5S MolecularWeight: 366.39222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2(C=CC=CC2C(=O)O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2(C=CC=CC2C(=O)O)C)C

InChI

InChI=1S/C15H18N4O5S/c1-9-8-10(2)17-13(16-9)18-14(22)19-25(23,24)15(3)7-5-4-6-11(15)12(20)21/h4-8,11H,1-3H3,(H,20,21)(H2,16,17,18,19,22)