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

Systemtic Name: 2-(6-oxidanylidene-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(6-oxo-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[6-oxo-2-(phenethylthio)-4-phenyl-1-pyrimidinyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(6-oxo-2-phenethylsulfanyl-4-phenylpyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[6-keto-2-(phenethylthio)-4-phenyl-pyrimidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C27H22F3N3O2S MolecularWeight: 509.54269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC(=CC(=O)N2CC(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC(=CC(=O)N2CC(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C27H22F3N3O2S/c28-27(29,30)21-12-7-13-22(16-21)31-24(34)18-33-25(35)17-23(20-10-5-2-6-11-20)32-26(33)36-15-14-19-8-3-1-4-9-19/h1-13,16-17H,14-15,18H2,(H,31,34)