2-[3-cyano-4-propyl-6-(trifluoromethylsulfonyl)pyridin-2-yl]sulfanylethanamide

Systemtic Name: 2-[3-cyano-4-propyl-6-(trifluoromethylsulfonyl)pyridin-2-yl]sulfanylethanamide Openeye Name: 2-[[3-cyano-4-propyl-6-(trifluoromethylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: 2-[[3-cyano-4-propyl-6-(trifluoromethylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: 2-[3-cyano-4-propyl-6-(trifluoromethylsulfonyl)pyridin-2-yl]sulfanylacetamide Traditional Name: 2-[(3-cyano-4-propyl-6-triflyl-2-pyridyl)thio]acetamide Formula: C12H12F3N3O3S2 MolecularWeight: 367.36719

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=C1C#N)SCC(=O)N)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCC1=CC(=NC(=C1C#N)SCC(=O)N)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O3S2/c1-2-3-7-4-10(23(20,21)12(13,14)15)18-11(8(7)5-16)22-6-9(17)19/h4H,2-3,6H2,1H3,(H2,17,19)