3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(5-chloranylpyridin-2-yl)propanamide

Systemtic Name: 3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(5-chloranylpyridin-2-yl)propanamide Openeye Name: 3-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-(5-chloro-2-pyridyl)propanamide CAS Name: 3-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-(5-chloro-2-pyridinyl)propanamide IUPAC Name: 3-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-(5-chloropyridin-2-yl)propanamide Traditional Name: 3-[(6-butyl-3-cyano-2-pyridyl)thio]-N-(5-chloro-2-pyridyl)propionamide Formula: C18H19ClN4OS MolecularWeight: 374.88766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C18H19ClN4OS/c1-2-3-4-15-7-5-13(11-20)18(22-15)25-10-9-17(24)23-16-8-6-14(19)12-21-16/h5-8,12H,2-4,9-10H2,1H3,(H,21,23,24)