5-methyl-2-methylsulfanyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 5-methyl-2-methylsulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 5-methyl-2-methylsulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 5-methyl-2-(methylthio)-6-propyl-4-pyrimidinolate IUPAC Name: 5-methyl-2-methylsulfanyl-6-propylpyrimidin-4-olate Traditional Name: 5-methyl-2-(methylthio)-6-propyl-pyrimidin-4-olate Formula: C9H13N2OS- MolecularWeight: 197.27732

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC(=N1)SC)[O-])C

Isomeric SMILES

CCCC1=C(C(=NC(=N1)SC)[O-])C

InChI

InChI=1S/C9H14N2OS/c1-4-5-7-6(2)8(12)11-9(10-7)13-3/h4-5H2,1-3H3,(H,10,11,12)/p-1