2-(6-butyl-3-cyano-pyridin-2-yl)sulfanylethanamide

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanylethanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]acetamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]acetamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanylacetamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]acetamide Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)N

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)N

InChI

InChI=1S/C12H15N3OS/c1-2-3-4-10-6-5-9(7-13)12(15-10)17-8-11(14)16/h5-6H,2-4,8H2,1H3,(H2,14,16)