N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(6-oxidanylidene-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)ethanamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(6-oxidanylidene-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)ethanamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(6-oxo-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)acetamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-oxo-2-(phenethylthio)-4-phenyl-1-pyrimidinyl]acetamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(6-oxo-2-phenethylsulfanyl-4-phenylpyrimidin-1-yl)acetamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-keto-2-(phenethylthio)-4-phenyl-pyrimidin-1-yl]acetamide Formula: C27H21ClF3N3O2S MolecularWeight: 543.98775

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H21ClF3N3O2S/c28-21-12-11-20(27(29,30)31)15-23(21)32-24(35)17-34-25(36)16-22(19-9-5-2-6-10-19)33-26(34)37-14-13-18-7-3-1-4-8-18/h1-12,15-16H,13-14,17H2,(H,32,35)