2-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-N-(2-ethoxyphenyl)butanamide

Systemtic Name: 2-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-N-(2-ethoxyphenyl)butanamide Openeye Name: 2-[(3-cyano-6-isopropyl-2-pyridyl)sulfanyl]-N-(2-ethoxyphenyl)butanamide CAS Name: 2-[(3-cyano-6-propan-2-yl-2-pyridinyl)thio]-N-(2-ethoxyphenyl)butanamide IUPAC Name: 2-(3-cyano-6-propan-2-ylpyridin-2-yl)sulfanyl-N-(2-ethoxyphenyl)butanamide Traditional Name: 2-[(3-cyano-6-isopropyl-2-pyridyl)thio]-N-o-phenetyl-butyramide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1OCC)SC2=C(C=CC(=N2)C(C)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1OCC)SC2=C(C=CC(=N2)C(C)C)C#N

InChI

InChI=1S/C21H25N3O2S/c1-5-19(20(25)23-17-9-7-8-10-18(17)26-6-2)27-21-15(13-22)11-12-16(24-21)14(3)4/h7-12,14,19H,5-6H2,1-4H3,(H,23,25)