2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)butanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)butanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(2-ethyl-6-methyl-phenyl)butanamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-(2-ethyl-6-methylphenyl)butanamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-(2-ethyl-6-methylphenyl)butanamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-(2-ethyl-6-methyl-phenyl)butyramide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=C(C(=CC(=N2)C)C)C#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=C(C(=CC(=N2)C)C)C#N)C

InChI

InChI=1S/C21H25N3OS/c1-6-16-10-8-9-13(3)19(16)24-20(25)18(7-2)26-21-17(12-22)14(4)11-15(5)23-21/h8-11,18H,6-7H2,1-5H3,(H,24,25)