ethyl 2-[1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-4-sulfanylidene-pyrimidin-5-yl]ethanoate

Systemtic Name: ethyl 2-[1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-4-sulfanylidene-pyrimidin-5-yl]ethanoate Openeye Name: ethyl 2-[1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-4-thioxo-pyrimidin-5-yl]acetate CAS Name: 2-[1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-oxo-4-sulfanylidene-5-pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxo-4-sulfanylidenepyrimidin-5-yl]acetate Traditional Name: 2-[1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-2-keto-4-thioxo-pyrimidin-5-yl]acetic acid ethyl ester Formula: C13H18N2O6S MolecularWeight: 330.35682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CN(C(=O)NC1=S)C2CC(C(O2)CO)O

Isomeric SMILES

CCOC(=O)CC1=CN(C(=O)NC1=S)C2CC(C(O2)CO)O

InChI

InChI=1S/C13H18N2O6S/c1-2-20-11(18)3-7-5-15(13(19)14-12(7)22)10-4-8(17)9(6-16)21-10/h5,8-10,16-17H,2-4,6H2,1H3,(H,14,19,22)