6-(1-tert-butyl-5-methyl-pyrazol-3-yl)-2-methylsulfanyl-pyrimidin-4-olate

Systemtic Name: 6-(1-tert-butyl-5-methyl-pyrazol-3-yl)-2-methylsulfanyl-pyrimidin-4-olate Openeye Name: 6-(1-tert-butyl-5-methyl-pyrazol-3-yl)-2-methylsulfanyl-pyrimidin-4-olate CAS Name: 6-(1-tert-butyl-5-methyl-3-pyrazolyl)-2-(methylthio)-4-pyrimidinolate IUPAC Name: 6-(1-tert-butyl-5-methylpyrazol-3-yl)-2-methylsulfanylpyrimidin-4-olate Traditional Name: 6-(1-tert-butyl-5-methyl-pyrazol-3-yl)-2-(methylthio)pyrimidin-4-olate Formula: C13H17N4OS- MolecularWeight: 277.36528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)(C)C)C2=CC(=NC(=N2)SC)[O-]

Isomeric SMILES

CC1=CC(=NN1C(C)(C)C)C2=CC(=NC(=N2)SC)[O-]

InChI

InChI=1S/C13H18N4OS/c1-8-6-10(16-17(8)13(2,3)4)9-7-11(18)15-12(14-9)19-5/h6-7H,1-5H3,(H,14,15,18)/p-1