ethyl 2-[2-[1,2-bis(bromanyl)propylsulfonylcarbamoylamino]-6-methyl-pyrimidin-4-yl]oxypropanoate

Systemtic Name: ethyl 2-[2-[1,2-bis(bromanyl)propylsulfonylcarbamoylamino]-6-methyl-pyrimidin-4-yl]oxypropanoate Openeye Name: ethyl 2-[2-(1,2-dibromopropylsulfonylcarbamoylamino)-6-methyl-pyrimidin-4-yl]oxypropanoate CAS Name: 2-[[2-[[(1,2-dibromopropylsulfonylamino)-oxomethyl]amino]-6-methyl-4-pyrimidinyl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[2-(1,2-dibromopropylsulfonylcarbamoylamino)-6-methylpyrimidin-4-yl]oxypropanoate Traditional Name: 2-[2-(1,2-dibromopropylsulfonylcarbamoylamino)-6-methyl-pyrimidin-4-yl]oxypropionic acid ethyl ester Formula: C14H20Br2N4O6S MolecularWeight: 532.2048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=NC(=NC(=C1)C)NC(=O)NS(=O)(=O)C(C(C)Br)Br

Isomeric SMILES

CCOC(=O)C(C)OC1=NC(=NC(=C1)C)NC(=O)NS(=O)(=O)C(C(C)Br)Br

InChI

InChI=1S/C14H20Br2N4O6S/c1-5-25-12(21)9(4)26-10-6-7(2)17-13(18-10)19-14(22)20-27(23,24)11(16)8(3)15/h6,8-9,11H,5H2,1-4H3,(H2,17,18,19,20,22)