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

Systemtic Name: 6-(1-tert-butyl-5-methyl-pyrazol-3-yl)-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-(1-tert-butyl-5-methyl-pyrazol-3-yl)-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-(1-tert-butyl-5-methyl-3-pyrazolyl)-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-(1-tert-butyl-5-methylpyrazol-3-yl)-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-(1-tert-butyl-5-methyl-pyrazol-3-yl)-2-(methylthio)-1H-pyrimidin-4-one Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)(C)C)C2=CC(=O)N=C(N2)SC

Isomeric SMILES

CC1=CC(=NN1C(C)(C)C)C2=CC(=O)N=C(N2)SC

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)