ethyl 6-(4-chlorophenyl)sulfanyl-2,5-dimethyl-pyrimidine-4-carboxylate

Systemtic Name: ethyl 6-(4-chlorophenyl)sulfanyl-2,5-dimethyl-pyrimidine-4-carboxylate Openeye Name: ethyl 6-(4-chlorophenyl)sulfanyl-2,5-dimethyl-pyrimidine-4-carboxylate CAS Name: 6-[(4-chlorophenyl)thio]-2,5-dimethyl-4-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-chlorophenyl)sulfanyl-2,5-dimethylpyrimidine-4-carboxylate Traditional Name: 6-[(4-chlorophenyl)thio]-2,5-dimethyl-pyrimidine-4-carboxylic acid ethyl ester Formula: C15H15ClN2O2S MolecularWeight: 322.8098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NC(=N1)C)SC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C(=NC(=N1)C)SC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C15H15ClN2O2S/c1-4-20-15(19)13-9(2)14(18-10(3)17-13)21-12-7-5-11(16)6-8-12/h5-8H,4H2,1-3H3