3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-pyridin-2-yl-propanamide

Systemtic Name: 3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-pyridin-2-yl-propanamide Openeye Name: 3-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-(2-pyridyl)propanamide CAS Name: 3-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-(2-pyridinyl)propanamide IUPAC Name: 3-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-pyridin-2-ylpropanamide Traditional Name: 3-[(6-butyl-3-cyano-2-pyridyl)thio]-N-(2-pyridyl)propionamide Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=CC=N2

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=CC=N2

InChI

InChI=1S/C18H20N4OS/c1-2-3-6-15-9-8-14(13-19)18(21-15)24-12-10-17(23)22-16-7-4-5-11-20-16/h4-5,7-9,11H,2-3,6,10,12H2,1H3,(H,20,22,23)