3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide

Systemtic Name: 3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)sulfanyl]-N-(2-methyl-4-quinolyl)propanamide CAS Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridinyl)thio]-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 3-(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)thio]-N-(2-methyl-4-quinolyl)propionamide Formula: C26H20N6OS MolecularWeight: 464.5416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)CCSC3=C(C(=C(C(=N3)N)C#N)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)CCSC3=C(C(=C(C(=N3)N)C#N)C4=CC=CC=C4)C#N

InChI

InChI=1S/C26H20N6OS/c1-16-13-22(18-9-5-6-10-21(18)30-16)31-23(33)11-12-34-26-20(15-28)24(17-7-3-2-4-8-17)19(14-27)25(29)32-26/h2-10,13H,11-12H2,1H3,(H2,29,32)(H,30,31,33)