2-(5-ethyl-4-methyl-6-oxidanidyl-pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: 2-(5-ethyl-4-methyl-6-oxidanidyl-pyrimidin-2-yl)sulfanylethanoate Openeye Name: 2-(5-ethyl-4-methyl-6-oxido-pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(5-ethyl-4-methyl-6-oxido-2-pyrimidinyl)thio]acetate IUPAC Name: 2-(5-ethyl-4-methyl-6-oxidopyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(5-ethyl-4-methyl-6-oxido-pyrimidin-2-yl)thio]acetate Formula: C9H10N2O3S-2 MolecularWeight: 226.2523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1[O-])SCC(=O)[O-])C

Isomeric SMILES

CCC1=C(N=C(N=C1[O-])SCC(=O)[O-])C

InChI

InChI=1S/C9H12N2O3S/c1-3-6-5(2)10-9(11-8(6)14)15-4-7(12)13/h3-4H2,1-2H3,(H,12,13)(H,10,11,14)/p-2