2-methylsulfanylethyl 6-(2-chloranyl-6-fluoranyl-phenyl)-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylsulfanylethyl 6-(2-chloranyl-6-fluoranyl-phenyl)-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methylsulfanylethyl 6-(2-chloro-6-fluoro-phenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(2-chloro-6-fluorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester IUPAC Name: 2-methylsulfanylethyl 6-(2-chloro-6-fluorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(2-chloro-6-fluoro-phenyl)-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester Formula: C16H18ClFN2O3S MolecularWeight: 372.842123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=C(C=CC=C2Cl)F)C(=O)OCCSC

Isomeric SMILES

CC1=C(C(NC(=O)N1C)C2=C(C=CC=C2Cl)F)C(=O)OCCSC

InChI

InChI=1S/C16H18ClFN2O3S/c1-9-12(15(21)23-7-8-24-3)14(19-16(22)20(9)2)13-10(17)5-4-6-11(13)18/h4-6,14H,7-8H2,1-3H3,(H,19,22)