ethyl 1-(4-chlorophenyl)-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-(4-chlorophenyl)-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-(4-chlorophenyl)-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-(4-chlorophenyl)-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-chlorophenyl)-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-(4-chlorophenyl)-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C14H13ClN2O3S MolecularWeight: 324.78262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)C2=CC=C(C=C2)Cl)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)C2=CC=C(C=C2)Cl)SC

InChI

InChI=1S/C14H13ClN2O3S/c1-3-20-13(19)11-8-16-14(21-2)17(12(11)18)10-6-4-9(15)5-7-10/h4-8H,3H2,1-2H3