2-[[4-(hydroxymethyl)-6-methyl-pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid

Systemtic Name: 2-[[4-(hydroxymethyl)-6-methyl-pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid Openeye Name: 2-[[4-(hydroxymethyl)-6-methyl-pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid CAS Name: 2-[[[[4-(hydroxymethyl)-6-methyl-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoic acid IUPAC Name: 2-[[4-(hydroxymethyl)-6-methylpyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid Traditional Name: 2-[(4-methyl-6-methylol-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid Formula: C14H14N4O6S MolecularWeight: 366.34916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O)CO

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O)CO

InChI

InChI=1S/C14H14N4O6S/c1-8-6-9(7-19)16-13(15-8)17-14(22)18-25(23,24)11-5-3-2-4-10(11)12(20)21/h2-6,19H,7H2,1H3,(H,20,21)(H2,15,16,17,18,22)