ethyl 6-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanylmethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanylmethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[4-chloro-3-(trifluoromethyl)phenyl]sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[4-chloro-3-(trifluoromethyl)phenyl]thio]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[4-chloro-3-(trifluoromethyl)phenyl]sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[[4-chloro-3-(trifluoromethyl)phenyl]thio]methyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H16ClF3N2O3S MolecularWeight: 408.82305

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H16ClF3N2O3S/c1-3-25-14(23)13-8(2)21-15(24)22-12(13)7-26-9-4-5-11(17)10(6-9)16(18,19)20/h4-6,8H,3,7H2,1-2H3,(H2,21,22,24)