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

Systemtic Name: ethyl 1-[(4-chlorophenyl)methyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[(4-chlorophenyl)methyl]-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[(4-chlorophenyl)methyl]-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-chlorophenyl)methyl]-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-(4-chlorobenzyl)-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C15H15ClN2O3S MolecularWeight: 338.8092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC2=CC=C(C=C2)Cl)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC2=CC=C(C=C2)Cl)SC

InChI

InChI=1S/C15H15ClN2O3S/c1-3-21-14(20)12-8-17-15(22-2)18(13(12)19)9-10-4-6-11(16)7-5-10/h4-8H,3,9H2,1-2H3