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

Systemtic Name: (2R)-2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]butanoate Openeye Name: (2R)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanoate CAS Name: (2R)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]butanoate IUPAC Name: (2R)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanoate Traditional Name: (2R)-2-[(6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]butyrate Formula: C10H13N2O3S- MolecularWeight: 241.28682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O3S/c1-3-6-5-8(13)12-10(11-6)16-7(4-2)9(14)15/h5,7H,3-4H2,1-2H3,(H,14,15)(H,11,12,13)/p-1/t7-/m1/s1