ethyl (6S)-3-ethyl-4-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6S)-3-ethyl-4-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-3-ethyl-4-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-ethyl-4-[[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-3-ethyl-4-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-ethyl-2-keto-4-[[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H23F3N4O3S MolecularWeight: 480.50323

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CSC3=NC(=CC(=N3)C(F)(F)F)C

Isomeric SMILES

CCN1C(=C([C@@H](NC1=O)C2=CC=CC=C2)C(=O)OCC)CSC3=NC(=CC(=N3)C(F)(F)F)C

InChI

InChI=1S/C22H23F3N4O3S/c1-4-29-15(12-33-20-26-13(3)11-16(27-20)22(23,24)25)17(19(30)32-5-2)18(28-21(29)31)14-9-7-6-8-10-14/h6-11,18H,4-5,12H2,1-3H3,(H,28,31)/t18-/m0/s1