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

Systemtic Name: ethyl 6-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[4-chloro-3-(trifluoromethyl)phenyl]sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[4-chloro-3-(trifluoromethyl)phenyl]thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[4-chloro-3-(trifluoromethyl)phenyl]sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[[4-chloro-3-(trifluoromethyl)phenyl]thio]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H14ClF3N2O3S MolecularWeight: 394.79647

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C15H14ClF3N2O3S/c1-2-24-13(22)9-6-20-14(23)21-12(9)7-25-8-3-4-11(16)10(5-8)15(17,18)19/h3-5H,2,6-7H2,1H3,(H2,20,21,23)