5-butyl-6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-olate

Systemtic Name: 5-butyl-6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-olate Openeye Name: 5-butyl-6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-olate CAS Name: 5-butyl-6-(methoxymethyl)-2-(methylthio)-4-pyrimidinolate IUPAC Name: 5-butyl-6-(methoxymethyl)-2-methylsulfanylpyrimidin-4-olate Traditional Name: 5-butyl-6-(methoxymethyl)-2-(methylthio)pyrimidin-4-olate Formula: C11H17N2O2S- MolecularWeight: 241.32988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(N=C1[O-])SC)COC

Isomeric SMILES

CCCCC1=C(N=C(N=C1[O-])SC)COC

InChI

InChI=1S/C11H18N2O2S/c1-4-5-6-8-9(7-15-2)12-11(16-3)13-10(8)14/h4-7H2,1-3H3,(H,12,13,14)/p-1