2-(2,2-dimethylpropanoylsulfanyl)-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-(2,2-dimethylpropanoylsulfanyl)-6-methyl-pyrimidin-4-olate Openeye Name: 2-(2,2-dimethylpropanoylsulfanyl)-6-methyl-pyrimidin-4-olate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-(2,2-dimethylpropanoylsulfanyl)-6-methylpyrimidin-4-olate Traditional Name: 6-methyl-2-(pivaloylthio)pyrimidin-4-olate Formula: C10H13N2O2S- MolecularWeight: 225.28742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(=O)C(C)(C)C)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SC(=O)C(C)(C)C)[O-]

InChI

InChI=1S/C10H14N2O2S/c1-6-5-7(13)12-9(11-6)15-8(14)10(2,3)4/h5H,1-4H3,(H,11,12,13)/p-1