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

Systemtic Name: 2-[3-cyano-6-(phenylmethyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-propan-2-yl-ethanamide Openeye Name: 2-[[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-isopropyl-acetamide CAS Name: 2-[[3-cyano-6-(phenylmethyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[6-benzyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-propan-2-ylacetamide Traditional Name: 2-[[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]thio]-N-isopropyl-acetamide Formula: C19H18F3N3OS MolecularWeight: 393.42593

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=C(C(=CC(=N1)CC2=CC=CC=C2)C(F)(F)F)C#N

Isomeric SMILES

CC(C)NC(=O)CSC1=C(C(=CC(=N1)CC2=CC=CC=C2)C(F)(F)F)C#N

InChI

InChI=1S/C19H18F3N3OS/c1-12(2)24-17(26)11-27-18-15(10-23)16(19(20,21)22)9-14(25-18)8-13-6-4-3-5-7-13/h3-7,9,12H,8,11H2,1-2H3,(H,24,26)