N-(2-cyano-3-methyl-butan-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C15H18F3N3OS MolecularWeight: 345.38313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C(C)SC1=NC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)C(C)SC1=NC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C15H18F3N3OS/c1-9(2)14(4,8-19)21-13(22)10(3)23-12-6-5-11(7-20-12)15(16,17)18/h5-7,9-10H,1-4H3,(H,21,22)