4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-3-cyano-6-(1H-imidazol-5-ylmethylamino)-N,N-dimethyl-quinoline-8-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-3-cyano-6-(1H-imidazol-5-ylmethylamino)-N,N-dimethyl-quinoline-8-carboxamide Openeye Name: 4-(3-chloro-4-fluoro-anilino)-3-cyano-6-(1H-imidazol-5-ylmethylamino)-N,N-dimethyl-quinoline-8-carboxamide CAS Name: 4-(3-chloro-4-fluoroanilino)-3-cyano-6-(1H-imidazol-5-ylmethylamino)-N,N-dimethyl-8-quinolinecarboxamide IUPAC Name: 4-(3-chloro-4-fluoroanilino)-3-cyano-6-(1H-imidazol-5-ylmethylamino)-N,N-dimethylquinoline-8-carboxamide Traditional Name: 4-(3-chloro-4-fluoro-anilino)-3-cyano-6-(1H-imidazol-5-ylmethylamino)-N,N-dimethyl-quinoline-8-carboxamide Formula: C23H19ClFN7O MolecularWeight: 463.894663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C2C(=CC(=C1)NCC3=CN=CN3)C(=C(C=N2)C#N)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CN(C)C(=O)C1=C2C(=CC(=C1)NCC3=CN=CN3)C(=C(C=N2)C#N)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C23H19ClFN7O/c1-32(2)23(33)18-6-15(28-11-16-10-27-12-30-16)5-17-21(13(8-26)9-29-22(17)18)31-14-3-4-20(25)19(24)7-14/h3-7,9-10,12,28H,11H2,1-2H3,(H,27,30)(H,29,31)