2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-ethanoylphenyl)ethanamide

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-ethanoylphenyl)ethanamide Openeye Name: N-(4-acetylphenyl)-2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]acetamide CAS Name: N-(4-acetylphenyl)-2-[(6-butyl-3-cyano-2-pyridinyl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-(6-butyl-3-cyanopyridin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetylphenyl)-2-[(6-butyl-3-cyano-2-pyridyl)thio]acetamide Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C20H21N3O2S/c1-3-4-5-17-11-8-16(12-21)20(23-17)26-13-19(25)22-18-9-6-15(7-10-18)14(2)24/h6-11H,3-5,13H2,1-2H3,(H,22,25)