N-[8-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-3-cyano-quinolin-6-yl]-2-(1H-imidazol-5-yl)ethanamide

Systemtic Name: N-[8-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-3-cyano-quinolin-6-yl]-2-(1H-imidazol-5-yl)ethanamide Openeye Name: N-[8-bromo-4-(3-chloro-4-fluoro-anilino)-3-cyano-6-quinolyl]-2-(1H-imidazol-5-yl)acetamide CAS Name: N-[8-bromo-4-(3-chloro-4-fluoroanilino)-3-cyano-6-quinolinyl]-2-(1H-imidazol-5-yl)acetamide IUPAC Name: N-[8-bromo-4-(3-chloro-4-fluoroanilino)-3-cyanoquinolin-6-yl]-2-(1H-imidazol-5-yl)acetamide Traditional Name: N-[8-bromo-4-(3-chloro-4-fluoro-anilino)-3-cyano-6-quinolyl]-2-(1H-imidazol-5-yl)acetamide Formula: C21H13BrClFN6O MolecularWeight: 499.722923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C=NC3=C(C=C(C=C32)NC(=O)CC4=CN=CN4)Br)C#N)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C=NC3=C(C=C(C=C32)NC(=O)CC4=CN=CN4)Br)C#N)Cl)F

InChI

InChI=1S/C21H13BrClFN6O/c22-16-4-13(29-19(31)6-14-9-26-10-28-14)3-15-20(11(7-25)8-27-21(15)16)30-12-1-2-18(24)17(23)5-12/h1-5,8-10H,6H2,(H,26,28)(H,27,30)(H,29,31)