ethyl 4-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H15ClN2O3S2 MolecularWeight: 382.8849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1SCC(=O)C2=CC=C(C=C2)Cl)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1SCC(=O)C2=CC=C(C=C2)Cl)SC

InChI

InChI=1S/C16H15ClN2O3S2/c1-3-22-15(21)12-8-18-16(23-2)19-14(12)24-9-13(20)10-4-6-11(17)7-5-10/h4-8H,3,9H2,1-2H3