3-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide

Systemtic Name: 3-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 3-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]-N-(2-methyl-4-quinolyl)propanamide CAS Name: 3-[(3-cyano-6-propyl-2-pyridinyl)thio]-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 3-(3-cyano-6-propylpyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 3-[(3-cyano-6-propyl-2-pyridyl)thio]-N-(2-methyl-4-quinolyl)propionamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C22H22N4OS/c1-3-6-17-10-9-16(14-23)22(25-17)28-12-11-21(27)26-20-13-15(2)24-19-8-5-4-7-18(19)20/h4-5,7-10,13H,3,6,11-12H2,1-2H3,(H,24,26,27)