2-pyrimidin-2-ylsulfanyl-5-sulfamoyl-benzoic acid

Systemtic Name: 2-pyrimidin-2-ylsulfanyl-5-sulfamoyl-benzoic acid Openeye Name: 2-pyrimidin-2-ylsulfanyl-5-sulfamoyl-benzoic acid CAS Name: 2-(2-pyrimidinylthio)-5-sulfamoylbenzoic acid IUPAC Name: 2-pyrimidin-2-ylsulfanyl-5-sulfamoylbenzoic acid Traditional Name: 2-(2-pyrimidylthio)-5-sulfamoyl-benzoic acid Formula: C11H9N3O4S2 MolecularWeight: 311.33686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1=CN=C(N=C1)SC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C11H9N3O4S2/c12-20(17,18)7-2-3-9(8(6-7)10(15)16)19-11-13-4-1-5-14-11/h1-6H,(H,15,16)(H2,12,17,18)