(2S)-2-[[5-(2-hydroxyethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]propanoate

Systemtic Name: (2S)-2-[[5-(2-hydroxyethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]propanoate Openeye Name: (2S)-2-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]propanoate CAS Name: (2S)-2-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]thio]propanoate IUPAC Name: (2S)-2-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]propanoate Traditional Name: (2S)-2-[[5-(2-hydroxyethyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]thio]propionate Formula: C10H13N2O4S- MolecularWeight: 257.28622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC(C)C(=O)[O-])CCO

Isomeric SMILES

CC1=C(C(=O)N=C(N1)S[C@@H](C)C(=O)[O-])CCO

InChI

InChI=1S/C10H14N2O4S/c1-5-7(3-4-13)8(14)12-10(11-5)17-6(2)9(15)16/h6,13H,3-4H2,1-2H3,(H,15,16)(H,11,12,14)/p-1/t6-/m0/s1