sulfamoyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-4-methylsulfanyl-benzoate

Systemtic Name: sulfamoyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-4-methylsulfanyl-benzoate Openeye Name: sulfamoyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-4-methylsulfanyl-benzoate CAS Name: 2-[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]-4-(methylthio)benzoic acid sulfamoyl ester IUPAC Name: sulfamoyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-4-methylsulfanylbenzoate Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-4-(methylthio)benzoic acid sulfamoyl ester Formula: C15H16N4O7S2 MolecularWeight: 428.44014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)C2=C(C=CC(=C2)SC)C(=O)OS(=O)(=O)N)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)C2=C(C=CC(=C2)SC)C(=O)OS(=O)(=O)N)OC

InChI

InChI=1S/C15H16N4O7S2/c1-24-11-7-12(25-2)18-15(17-11)19-13(20)10-6-8(27-3)4-5-9(10)14(21)26-28(16,22)23/h4-7H,1-3H3,(H2,16,22,23)(H,17,18,19,20)