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

Systemtic Name: [(2S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl propanoate Openeye Name: [(2S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl propanoate CAS Name: propanoic acid [(2S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-1,3-oxathiolan-2-yl]methyl ester IUPAC Name: [(2S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl propanoate Traditional Name: propionic acid [(2S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl ester Formula: C11H15N3O4S MolecularWeight: 285.3195

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1OC(CS1)N2C=CC(=NC2=O)N

Isomeric SMILES

CCC(=O)OC[C@H]1O[C@H](CS1)N2C=CC(=NC2=O)N

InChI

InChI=1S/C11H15N3O4S/c1-2-9(15)17-5-10-18-8(6-19-10)14-4-3-7(12)13-11(14)16/h3-4,8,10H,2,5-6H2,1H3,(H2,12,13,16)/t8-,10+/m1/s1