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

Systemtic Name: 2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-6-methyl-benzoic acid Openeye Name: 2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-6-methyl-benzoic acid CAS Name: 2-[[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-6-methylbenzoic acid IUPAC Name: 2-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoylsulfamoyl]-6-methylbenzoic acid Traditional Name: 2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-6-methyl-benzoic acid Formula: C15H16N4O6S MolecularWeight: 380.37574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)C)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)C)C(=O)O

InChI

InChI=1S/C15H16N4O6S/c1-8-5-4-6-10(12(8)13(20)21)26(23,24)19-15(22)18-14-16-9(2)7-11(17-14)25-3/h4-7H,1-3H3,(H,20,21)(H2,16,17,18,19,22)