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

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-propan-2-yl-pyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 2-[(6-amino-3,5-dicyano-4-isopropyl-2-pyridyl)sulfanyl]-N-(2-methyl-4-quinolyl)propanamide CAS Name: 2-[(6-amino-3,5-dicyano-4-propan-2-yl-2-pyridinyl)thio]-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-propan-2-ylpyridin-2-yl)sulfanyl-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 2-[(6-amino-3,5-dicyano-4-isopropyl-2-pyridyl)thio]-N-(2-methyl-4-quinolyl)propionamide Formula: C23H22N6OS MolecularWeight: 430.52538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)SC3=C(C(=C(C(=N3)N)C#N)C(C)C)C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)SC3=C(C(=C(C(=N3)N)C#N)C(C)C)C#N

InChI

InChI=1S/C23H22N6OS/c1-12(2)20-16(10-24)21(26)29-23(17(20)11-25)31-14(4)22(30)28-19-9-13(3)27-18-8-6-5-7-15(18)19/h5-9,12,14H,1-4H3,(H2,26,29)(H,27,28,30)