methyl 2-cyano-2-(5-cyano-2-methyl-6-methylsulfanyl-pyrimidin-4-yl)ethanoate

Systemtic Name: methyl 2-cyano-2-(5-cyano-2-methyl-6-methylsulfanyl-pyrimidin-4-yl)ethanoate Openeye Name: methyl 2-cyano-2-(5-cyano-2-methyl-6-methylsulfanyl-pyrimidin-4-yl)acetate CAS Name: 2-cyano-2-[5-cyano-2-methyl-6-(methylthio)-4-pyrimidinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-(5-cyano-2-methyl-6-methylsulfanylpyrimidin-4-yl)acetate Traditional Name: 2-cyano-2-[5-cyano-2-methyl-6-(methylthio)pyrimidin-4-yl]acetic acid methyl ester Formula: C11H10N4O2S MolecularWeight: 262.2877

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)SC)C#N)C(C#N)C(=O)OC

Isomeric SMILES

CC1=NC(=C(C(=N1)SC)C#N)C(C#N)C(=O)OC

InChI

InChI=1S/C11H10N4O2S/c1-6-14-9(8(5-13)11(16)17-2)7(4-12)10(15-6)18-3/h8H,1-3H3