2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)propanamide

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)propanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-(4-chloro-2-methoxy-5-methyl-phenyl)propanamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]-N-(4-chloro-2-methoxy-5-methyl-phenyl)propionamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O2S/c1-5-6-7-16-9-8-15(12-23)21(24-16)28-14(3)20(26)25-18-10-13(2)17(22)11-19(18)27-4/h8-11,14H,5-7H2,1-4H3,(H,25,26)