N-tert-butyl-2-[[3-cyano-6-oxidanylidene-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-tert-butyl-2-[[3-cyano-6-oxidanylidene-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]ethanamide Openeye Name: N-tert-butyl-2-[[3-cyano-6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]acetamide CAS Name: N-tert-butyl-2-[[3-cyano-6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]thio]acetamide IUPAC Name: N-tert-butyl-2-[[3-cyano-6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]acetamide Traditional Name: N-tert-butyl-2-[[3-cyano-6-keto-4-(trifluoromethyl)-1H-pyridin-2-yl]thio]acetamide Formula: C13H14F3N3O2S MolecularWeight: 333.32937

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14F3N3O2S/c1-12(2,3)19-10(21)6-22-11-7(5-17)8(13(14,15)16)4-9(20)18-11/h4H,6H2,1-3H3,(H,18,20)(H,19,21)