2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)propanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-(4-isopropylphenyl)propanamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)propanamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]-N-p-cumenyl-propionamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3OS/c1-5-6-7-19-13-10-18(14-23)22(25-19)27-16(4)21(26)24-20-11-8-17(9-12-20)15(2)3/h8-13,15-16H,5-7H2,1-4H3,(H,24,26)