(2R)-2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoate

Systemtic Name: (2R)-2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoate Openeye Name: (2R)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate CAS Name: (2R)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]propanoate IUPAC Name: (2R)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate Traditional Name: (2R)-2-[(6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]propionate Formula: C9H11N2O3S- MolecularWeight: 227.26024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SC(C)C(=O)[O-]

Isomeric SMILES

CCC1=CC(=O)N=C(N1)S[C@H](C)C(=O)[O-]

InChI

InChI=1S/C9H12N2O3S/c1-3-6-4-7(12)11-9(10-6)15-5(2)8(13)14/h4-5H,3H2,1-2H3,(H,13,14)(H,10,11,12)/p-1/t5-/m1/s1