N-(2-cyanophenyl)-2-[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyanophenyl)-2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(2-cyanophenyl)-2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(2-cyanophenyl)-2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C22H13F3N4OS MolecularWeight: 438.42503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C22H13F3N4OS/c23-22(24,25)17-10-19(14-6-2-1-3-7-14)29-21(16(17)12-27)31-13-20(30)28-18-9-5-4-8-15(18)11-26/h1-10H,13H2,(H,28,30)