N-(1-cyanocycloheptyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C18H19F3N4OS MolecularWeight: 396.42987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)NC2(CCCCCC2)C#N

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)NC2(CCCCCC2)C#N

InChI

InChI=1S/C18H19F3N4OS/c1-12-8-14(18(19,20)21)13(9-22)16(24-12)27-10-15(26)25-17(11-23)6-4-2-3-5-7-17/h8H,2-7,10H2,1H3,(H,25,26)