2-(4-oxidanidyl-6-propan-2-yl-pyrimidin-2-yl)sulfanylethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)SCC(=O)[O-])[O-]

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)SCC(=O)[O-])[O-]

InChI

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