ethyl 4-[[6-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]butanoate

Systemtic Name: ethyl 4-[[6-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]butanoate Openeye Name: ethyl 4-[[6-(2-methoxy-2-oxo-ethyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]butanoate CAS Name: 4-[[6-(2-methoxy-2-oxoethyl)-4-oxo-1H-pyrimidin-2-yl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[6-(2-methoxy-2-oxoethyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]butanoate Traditional Name: 4-[[4-keto-6-(2-keto-2-methoxy-ethyl)-1H-pyrimidin-2-yl]thio]butyric acid ethyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC(=O)C=C(N1)CC(=O)OC

Isomeric SMILES

CCOC(=O)CCCSC1=NC(=O)C=C(N1)CC(=O)OC

InChI

InChI=1S/C13H18N2O5S/c1-3-20-11(17)5-4-6-21-13-14-9(7-10(16)15-13)8-12(18)19-2/h7H,3-6,8H2,1-2H3,(H,14,15,16)