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

Systemtic Name: 2-[(4-cyano-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid Openeye Name: 2-[(4-cyano-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid CAS Name: 2-[[[(4-cyano-6-methyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]benzoic acid IUPAC Name: 2-[(4-cyano-6-methylpyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid Traditional Name: 2-[(4-cyano-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid Formula: C14H11N5O5S MolecularWeight: 361.33264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C#N)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=NC(=NC(=C1)C#N)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H11N5O5S/c1-8-6-9(7-15)17-13(16-8)18-14(22)19-25(23,24)11-5-3-2-4-10(11)12(20)21/h2-6H,1H3,(H,20,21)(H2,16,17,18,19,22)