2-[3-chloranyl-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazol-4-yl]ethanoate

Systemtic Name: 2-[3-chloranyl-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazol-4-yl]ethanoate Openeye Name: 2-[3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazol-4-yl]acetate CAS Name: 2-[3-chloro-5-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-1-methyl-4-pyrazolyl]acetate IUPAC Name: 2-[3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazol-4-yl]acetate Traditional Name: 2-[3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazol-4-yl]acetate Formula: C13H14ClN6O7S- MolecularWeight: 433.80426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)Cl)CC(=O)[O-])S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CN1C(=C(C(=N1)Cl)CC(=O)[O-])S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C13H15ClN6O7S/c1-20-11(6(4-9(21)22)10(14)18-20)28(24,25)19-13(23)17-12-15-7(26-2)5-8(16-12)27-3/h5H,4H2,1-3H3,(H,21,22)(H2,15,16,17,19,23)/p-1