4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-3-keto-butyronitrile Formula: C12H9ClF3N3OS MolecularWeight: 335.73257

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9ClF3N3OS/c1-6(18)8(3-17)10(20)5-21-11-9(13)2-7(4-19-11)12(14,15)16/h2,4,8,18H,5H2,1H3