N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-(4,6-diphenylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-(4,6-diphenylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4,6-diphenylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(4,6-diphenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(4,6-diphenylpyrimidin-2-yl)thio]acetamide Formula: C25H17ClF3N3OS MolecularWeight: 499.93519

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C25H17ClF3N3OS/c26-20-12-11-18(13-19(20)25(27,28)29)30-23(33)15-34-24-31-21(16-7-3-1-4-8-16)14-22(32-24)17-9-5-2-6-10-17/h1-14H,15H2,(H,30,33)