N-[2,5-bis(chloranyl)phenyl]-2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-propanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-(2,5-dichlorophenyl)propanamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-(2,5-dichlorophenyl)propanamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-(2,5-dichlorophenyl)propanamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]-N-(2,5-dichlorophenyl)propionamide Formula: C19H19Cl2N3OS MolecularWeight: 408.34466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19Cl2N3OS/c1-3-4-5-15-8-6-13(11-22)19(23-15)26-12(2)18(25)24-17-10-14(20)7-9-16(17)21/h6-10,12H,3-5H2,1-2H3,(H,24,25)