ethyl 4-iodanyl-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-iodanyl-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-iodo-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-iodo-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-iodo-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-iodo-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C8H9IN2O2S MolecularWeight: 324.13873

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1I)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1I)SC

InChI

InChI=1S/C8H9IN2O2S/c1-3-13-7(12)5-4-10-8(14-2)11-6(5)9/h4H,3H2,1-2H3