2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)butanamide

Systemtic Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)butanamide Openeye Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)butanamide CAS Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-N-(3,5-dimethylphenyl)butanamide IUPAC Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)butanamide Traditional Name: 2-[(3-cyano-1-pyrindan-2-yl)thio]-N-(3,5-dimethylphenyl)butyramide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC(=C1)C)C)SC2=NC3=C(CCC3)C=C2C#N

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC(=C1)C)C)SC2=NC3=C(CCC3)C=C2C#N

InChI

InChI=1S/C21H23N3OS/c1-4-19(20(25)23-17-9-13(2)8-14(3)10-17)26-21-16(12-22)11-15-6-5-7-18(15)24-21/h8-11,19H,4-7H2,1-3H3,(H,23,25)