[(2S,5R)-5-(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl butanoate

Systemtic Name: [(2S,5R)-5-(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl butanoate Openeye Name: [(2S,5R)-5-(4-acetamido-2-oxo-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl butanoate CAS Name: butanoic acid [(2S,5R)-5-(4-acetamido-2-oxo-1-pyrimidinyl)-1,3-oxathiolan-2-yl]methyl ester IUPAC Name: [(2S,5R)-5-(4-acetamido-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl butanoate Traditional Name: butyric acid [(2S,5R)-5-(4-acetamido-2-keto-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl ester Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1OC(CS1)N2C=CC(=NC2=O)NC(=O)C

Isomeric SMILES

CCCC(=O)OC[C@H]1O[C@H](CS1)N2C=CC(=NC2=O)NC(=O)C

InChI

InChI=1S/C14H19N3O5S/c1-3-4-12(19)21-7-13-22-11(8-23-13)17-6-5-10(15-9(2)18)16-14(17)20/h5-6,11,13H,3-4,7-8H2,1-2H3,(H,15,16,18,20)/t11-,13+/m1/s1