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

Systemtic Name: 2-[6-oxidanylidene-4-phenyl-2-(phenylmethylsulfanyl)pyrimidin-1-yl]-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(2-benzylsulfanyl-6-oxo-4-phenyl-pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[6-oxo-4-phenyl-2-(phenylmethylthio)-1-pyrimidinyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(2-benzylsulfanyl-6-oxo-4-phenylpyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[2-(benzylthio)-6-keto-4-phenyl-pyrimidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C26H20F3N3O2S MolecularWeight: 495.51611

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2CC(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2CC(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C26H20F3N3O2S/c27-26(28,29)20-12-7-13-21(14-20)30-23(33)16-32-24(34)15-22(19-10-5-2-6-11-19)31-25(32)35-17-18-8-3-1-4-9-18/h1-15H,16-17H2,(H,30,33)