8-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(1-methylimidazol-4-yl)methylamino]quinoline-3-carbonitrile

Systemtic Name: 8-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(1-methylimidazol-4-yl)methylamino]quinoline-3-carbonitrile Openeye Name: 8-bromo-4-(3-chloro-4-fluoro-anilino)-6-[(1-methylimidazol-4-yl)methylamino]quinoline-3-carbonitrile CAS Name: 8-bromo-4-(3-chloro-4-fluoroanilino)-6-[(1-methyl-4-imidazolyl)methylamino]-3-quinolinecarbonitrile IUPAC Name: 8-bromo-4-(3-chloro-4-fluoroanilino)-6-[(1-methylimidazol-4-yl)methylamino]quinoline-3-carbonitrile Traditional Name: 8-bromo-4-(3-chloro-4-fluoro-anilino)-6-[(1-methylimidazol-4-yl)methylamino]quinoline-3-carbonitrile Formula: C21H15BrClFN6 MolecularWeight: 485.739403

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)CNC2=CC(=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=C(C=C4)F)Cl)Br

Isomeric SMILES

CN1C=C(N=C1)CNC2=CC(=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=C(C=C4)F)Cl)Br

InChI

InChI=1S/C21H15BrClFN6/c1-30-10-15(28-11-30)9-26-14-4-16-20(29-13-2-3-19(24)18(23)6-13)12(7-25)8-27-21(16)17(22)5-14/h2-6,8,10-11,26H,9H2,1H3,(H,27,29)