2-(4-methyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-methyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4-methyl-6-oxo-2-phenethylsulfanyl-pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-methyl-6-oxo-2-(phenethylthio)-1-pyrimidinyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4-methyl-6-oxo-2-phenethylsulfanylpyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[6-keto-4-methyl-2-(phenethylthio)pyrimidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C22H20F3N3O2S MolecularWeight: 447.47331

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCCC2=CC=CC=C2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCCC2=CC=CC=C2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H20F3N3O2S/c1-15-12-20(30)28(21(26-15)31-11-10-16-6-3-2-4-7-16)14-19(29)27-18-9-5-8-17(13-18)22(23,24)25/h2-9,12-13H,10-11,14H2,1H3,(H,27,29)