methyl 2-(5-cyano-2-methylsulfanyl-pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: methyl 2-(5-cyano-2-methylsulfanyl-pyrimidin-4-yl)sulfanylethanoate Openeye Name: methyl 2-(5-cyano-2-methylsulfanyl-pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[[5-cyano-2-(methylthio)-4-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-(5-cyano-2-methylsulfanylpyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[[5-cyano-2-(methylthio)pyrimidin-4-yl]thio]acetic acid methyl ester Formula: C9H9N3O2S2 MolecularWeight: 255.31666

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=NC=C1C#N)SC

Isomeric SMILES

COC(=O)CSC1=NC(=NC=C1C#N)SC

InChI

InChI=1S/C9H9N3O2S2/c1-14-7(13)5-16-8-6(3-10)4-11-9(12-8)15-2/h4H,5H2,1-2H3