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

Systemtic Name: N-(4-acetamidophenyl)-2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[(6-butyl-3-cyano-2-pyridinyl)thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(6-butyl-3-cyanopyridin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[(6-butyl-3-cyano-2-pyridyl)thio]acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2S/c1-3-4-5-16-7-6-15(12-21)20(24-16)27-13-19(26)23-18-10-8-17(9-11-18)22-14(2)25/h6-11H,3-5,13H2,1-2H3,(H,22,25)(H,23,26)