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

Systemtic Name: methyl 4-acetamido-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate Openeye Name: methyl 4-acetamido-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate CAS Name: 4-acetamido-2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-acetamido-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate Traditional Name: 4-acetamido-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C17H19N5O8S MolecularWeight: 453.42646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C17H19N5O8S/c1-9(23)18-10-5-6-11(15(24)30-4)12(7-10)31(26,27)22-17(25)21-16-19-13(28-2)8-14(20-16)29-3/h5-8H,1-4H3,(H,18,23)(H2,19,20,21,22,25)