3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]sulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]-4-methoxy-benzoic acid Formula: C20H20N4O7S2 MolecularWeight: 492.5254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)OC)C

InChI

InChI=1S/C20H20N4O7S2/c1-12-10-13(2)22-20(21-12)24-32(27,28)16-7-5-15(6-8-16)23-33(29,30)18-11-14(19(25)26)4-9-17(18)31-3/h4-11,23H,1-3H3,(H,25,26)(H,21,22,24)