2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)butanamide

Systemtic Name: 2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)butanamide Openeye Name: 2-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]-N-(2-ethyl-6-methyl-phenyl)butanamide CAS Name: 2-[(3-cyano-6-propyl-2-pyridinyl)thio]-N-(2-ethyl-6-methylphenyl)butanamide IUPAC Name: 2-(3-cyano-6-propylpyridin-2-yl)sulfanyl-N-(2-ethyl-6-methylphenyl)butanamide Traditional Name: 2-[(3-cyano-6-propyl-2-pyridyl)thio]-N-(2-ethyl-6-methyl-phenyl)butyramide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)NC2=C(C=CC=C2CC)C

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)NC2=C(C=CC=C2CC)C

InChI

InChI=1S/C22H27N3OS/c1-5-9-18-13-12-17(14-23)22(24-18)27-19(7-3)21(26)25-20-15(4)10-8-11-16(20)6-2/h8,10-13,19H,5-7,9H2,1-4H3,(H,25,26)