3-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-(3,5-dimethylphenyl)propanamide

Systemtic Name: 3-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-(3,5-dimethylphenyl)propanamide Openeye Name: 3-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]-N-(3,5-dimethylphenyl)propanamide CAS Name: 3-[(3-cyano-6-propyl-2-pyridinyl)thio]-N-(3,5-dimethylphenyl)propanamide IUPAC Name: 3-(3-cyano-6-propylpyridin-2-yl)sulfanyl-N-(3,5-dimethylphenyl)propanamide Traditional Name: 3-[(3-cyano-6-propyl-2-pyridyl)thio]-N-(3,5-dimethylphenyl)propionamide Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C20H23N3OS/c1-4-5-17-7-6-16(13-21)20(23-17)25-9-8-19(24)22-18-11-14(2)10-15(3)12-18/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,22,24)