ethyl 2-[5-cyano-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[5-cyano-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanylethanoate Openeye Name: ethyl 2-[5-cyano-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[5-cyano-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-cyano-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[5-cyano-2-(2-furyl)-6-methyl-pyrimidin-4-yl]thio]acetic acid ethyl ester Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=NC(=C1C#N)C)C2=CC=CO2

Isomeric SMILES

CCOC(=O)CSC1=NC(=NC(=C1C#N)C)C2=CC=CO2

InChI

InChI=1S/C14H13N3O3S/c1-3-19-12(18)8-21-14-10(7-15)9(2)16-13(17-14)11-5-4-6-20-11/h4-6H,3,8H2,1-2H3