2-(4-tert-butyl-6-oxidanidyl-pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: 2-(4-tert-butyl-6-oxidanidyl-pyrimidin-2-yl)sulfanylethanoate Openeye Name: 2-(4-tert-butyl-6-oxido-pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4-tert-butyl-6-oxido-2-pyrimidinyl)thio]acetate IUPAC Name: 2-(4-tert-butyl-6-oxidopyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4-tert-butyl-6-oxido-pyrimidin-2-yl)thio]acetate Formula: C10H12N2O3S-2 MolecularWeight: 240.27888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O3S/c1-10(2,3)6-4-7(13)12-9(11-6)16-5-8(14)15/h4H,5H2,1-3H3,(H,14,15)(H,11,12,13)/p-2