methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methylsulfonylamino)benzoate

Systemtic Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methylsulfonylamino)benzoate Openeye Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methanesulfonamido)benzoate CAS Name: 2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-4-(methanesulfonamido)benzoic acid methyl ester IUPAC Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methanesulfonamido)benzoate Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methanesulfonamido)benzoic acid methyl ester Formula: C16H19N5O9S2 MolecularWeight: 489.48016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C)C(=O)OC)OC

InChI

InChI=1S/C16H19N5O9S2/c1-28-12-8-13(29-2)18-15(17-12)19-16(23)21-32(26,27)11-7-9(20-31(4,24)25)5-6-10(11)14(22)30-3/h5-8,20H,1-4H3,(H2,17,18,19,21,23)