N-tert-butyl-2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-tert-butyl-2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-tert-butyl-2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-tert-butyl-2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-tert-butyl-2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-tert-butyl-2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C18H18F3N3OS2 MolecularWeight: 413.48023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SC1=C(C(=CC(=N1)C2=CC=CS2)C(F)(F)F)C#N

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SC1=C(C(=CC(=N1)C2=CC=CS2)C(F)(F)F)C#N

InChI

InChI=1S/C18H18F3N3OS2/c1-10(15(25)24-17(2,3)4)27-16-11(9-22)12(18(19,20)21)8-13(23-16)14-6-5-7-26-14/h5-8,10H,1-4H3,(H,24,25)