ethyl 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[(2-chloro-6-fluoro-phenyl)methyl]-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-chloro-6-fluorophenyl)methyl]-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C15H14ClFN2O3S MolecularWeight: 356.799663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC2=C(C=CC=C2Cl)F)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC2=C(C=CC=C2Cl)F)SC

InChI

InChI=1S/C15H14ClFN2O3S/c1-3-22-14(21)9-7-18-15(23-2)19(13(9)20)8-10-11(16)5-4-6-12(10)17/h4-7H,3,8H2,1-2H3