ethyl 2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpyrimidin-4-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpyrimidin-4-yl]sulfanylethanoate Openeye Name: ethyl 2-[2-(2-ethoxy-2-oxo-ethyl)sulfanylpyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[2-[(2-ethoxy-2-oxoethyl)thio]-4-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-ethoxy-2-oxoethyl)sulfanylpyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[2-[(2-ethoxy-2-keto-ethyl)thio]pyrimidin-4-yl]thio]acetic acid ethyl ester Formula: C12H16N2O4S2 MolecularWeight: 316.39644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=NC=C1)SCC(=O)OCC

Isomeric SMILES

CCOC(=O)CSC1=NC(=NC=C1)SCC(=O)OCC

InChI

InChI=1S/C12H16N2O4S2/c1-3-17-10(15)7-19-9-5-6-13-12(14-9)20-8-11(16)18-4-2/h5-6H,3-4,7-8H2,1-2H3