diethyl 2-(4-azanyl-5-ethoxycarbonyl-pyrimidin-2-yl)sulfanylpropanedioate

Systemtic Name: diethyl 2-(4-azanyl-5-ethoxycarbonyl-pyrimidin-2-yl)sulfanylpropanedioate Openeye Name: diethyl 2-(4-amino-5-ethoxycarbonyl-pyrimidin-2-yl)sulfanylpropanedioate CAS Name: 2-[(4-amino-5-ethoxycarbonyl-2-pyrimidinyl)thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-amino-5-ethoxycarbonylpyrimidin-2-yl)sulfanylpropanedioate Traditional Name: 2-[(4-amino-5-carbethoxy-pyrimidin-2-yl)thio]malonic acid diethyl ester Formula: C14H19N3O6S MolecularWeight: 357.38216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SC(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C14H19N3O6S/c1-4-21-11(18)8-7-16-14(17-10(8)15)24-9(12(19)22-5-2)13(20)23-6-3/h7,9H,4-6H2,1-3H3,(H2,15,16,17)