methyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]benzoate

Systemtic Name: methyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]benzoate Openeye Name: methyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]benzoate CAS Name: 4-[[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]benzoate Traditional Name: 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamoyl]benzoic acid methyl ester Formula: C20H20N4O6S2 MolecularWeight: 476.526

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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=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O6S2/c1-13-12-14(2)22-20(21-13)24-32(28,29)18-10-6-16(7-11-18)23-31(26,27)17-8-4-15(5-9-17)19(25)30-3/h4-12,23H,1-3H3,(H,21,22,24)