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

Systemtic Name: N-(tert-butylcarbamoyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(tert-butylcarbamoyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(tert-butylcarbamoyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(tert-butylcarbamoyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C16H19F3N4O2S MolecularWeight: 388.40787

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C)C(=O)NC(=O)NC(C)(C)C

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C)C(=O)NC(=O)NC(C)(C)C

InChI

InChI=1S/C16H19F3N4O2S/c1-8-6-11(16(17,18)19)10(7-20)13(21-8)26-9(2)12(24)22-14(25)23-15(3,4)5/h6,9H,1-5H3,(H2,22,23,24,25)