1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea; methyl 3-chloranyl-1-methyl-pyrazole-4-carboxylate

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea; methyl 3-chloranyl-1-methyl-pyrazole-4-carboxylate Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea; methyl 3-chloro-1-methyl-pyrazole-4-carboxylate CAS Name: 3-chloro-1-methyl-4-pyrazolecarboxylic acid methyl ester; 1-(4,6-dimethoxy-2-pyrimidinyl)-3-sulfonylurea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonylurea; methyl 3-chloro-1-methylpyrazole-4-carboxylate Traditional Name: 3-chloro-1-methyl-pyrazole-4-carboxylic acid methyl ester; 1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea Formula: C13H15ClN6O7S MolecularWeight: 434.8122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)Cl)C(=O)OC.COC1=CC(=NC(=N1)NC(=O)N=S(=O)=O)OC

Isomeric SMILES

CN1C=C(C(=N1)Cl)C(=O)OC.COC1=CC(=NC(=N1)NC(=O)N=S(=O)=O)OC

InChI

InChI=1S/C7H8N4O5S.C6H7ClN2O2/c1-15-4-3-5(16-2)9-6(8-4)10-7(12)11-17(13)14;1-9-3-4(5(7)8-9)6(10)11-2/h3H,1-2H3,(H,8,9,10,12);3H,1-2H3