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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19Cl2N3OS/c1-2-3-4-16-6-5-13(12-22)19(24-16)26-8-7-18(25)23-17-10-14(20)9-15(21)11-17/h5-6,9-11H,2-4,7-8H2,1H3,(H,23,25)