ethyl 3-[5-(aminocarbonylcarbamoyl)-4,6-dimethoxy-pyrimidin-2-yl]sulfonyl-1-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-[5-(aminocarbonylcarbamoyl)-4,6-dimethoxy-pyrimidin-2-yl]sulfonyl-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 3-(5-allophanoyl-4,6-dimethoxy-pyrimidin-2-yl)sulfonyl-1-methyl-pyrazole-4-carboxylate CAS Name: 3-[[5-[(carbamoylamino)-oxomethyl]-4,6-dimethoxy-2-pyrimidinyl]sulfonyl]-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[5-(carbamoylcarbamoyl)-4,6-dimethoxypyrimidin-2-yl]sulfonyl-1-methylpyrazole-4-carboxylate Traditional Name: 3-(5-allophanoyl-4,6-dimethoxy-pyrimidin-2-yl)sulfonyl-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H18N6O8S MolecularWeight: 442.40382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1S(=O)(=O)C2=NC(=C(C(=N2)OC)C(=O)NC(=O)N)OC)C

Isomeric SMILES

CCOC(=O)C1=CN(N=C1S(=O)(=O)C2=NC(=C(C(=N2)OC)C(=O)NC(=O)N)OC)C

InChI

InChI=1S/C15H18N6O8S/c1-5-29-13(23)7-6-21(2)20-12(7)30(25,26)15-18-10(27-3)8(11(19-15)28-4)9(22)17-14(16)24/h6H,5H2,1-4H3,(H3,16,17,22,24)