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

Systemtic Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)butanamide Openeye Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)butanamide CAS Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-N-(3,5-dimethoxyphenyl)butanamide IUPAC Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)butanamide Traditional Name: 2-[(3-cyano-1-pyrindan-2-yl)thio]-N-(3,5-dimethoxyphenyl)butyramide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-4-19(20(25)23-15-9-16(26-2)11-17(10-15)27-3)28-21-14(12-22)8-13-6-5-7-18(13)24-21/h8-11,19H,4-7H2,1-3H3,(H,23,25)