2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide

Systemtic Name: 2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide Openeye Name: 2-[(3-cyano-6-isobutyl-2-pyridyl)sulfanyl]-N-(2-ethoxyphenyl)propanamide CAS Name: 2-[[3-cyano-6-(2-methylpropyl)-2-pyridinyl]thio]-N-(2-ethoxyphenyl)propanamide IUPAC Name: 2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide Traditional Name: 2-[(3-cyano-6-isobutyl-2-pyridyl)thio]-N-o-phenetyl-propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)SC2=C(C=CC(=N2)CC(C)C)C#N

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C)SC2=C(C=CC(=N2)CC(C)C)C#N

InChI

InChI=1S/C21H25N3O2S/c1-5-26-19-9-7-6-8-18(19)24-20(25)15(4)27-21-16(13-22)10-11-17(23-21)12-14(2)3/h6-11,14-15H,5,12H2,1-4H3,(H,24,25)