2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-3-methyl-benzoic acid

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-3-methyl-benzoic acid Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-3-methyl-benzoic acid CAS Name: 2-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-3-methylbenzoic acid IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-3-methylbenzoic acid Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-3-methyl-benzoic acid Formula: C15H16N4O5S MolecularWeight: 364.37634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)C)C)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)C)C)C(=O)O

InChI

InChI=1S/C15H16N4O5S/c1-8-5-4-6-11(13(20)21)12(8)25(23,24)19-15(22)18-14-16-9(2)7-10(3)17-14/h4-7H,1-3H3,(H,20,21)(H2,16,17,18,19,22)