8-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(2-methylpyrazol-3-yl)methylamino]quinoline-3-carbonitrile

Systemtic Name: 8-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(2-methylpyrazol-3-yl)methylamino]quinoline-3-carbonitrile Openeye Name: 8-bromo-4-(3-chloro-4-fluoro-anilino)-6-[(2-methylpyrazol-3-yl)methylamino]quinoline-3-carbonitrile CAS Name: 8-bromo-4-(3-chloro-4-fluoroanilino)-6-[(2-methyl-3-pyrazolyl)methylamino]-3-quinolinecarbonitrile IUPAC Name: 8-bromo-4-(3-chloro-4-fluoroanilino)-6-[(2-methylpyrazol-3-yl)methylamino]quinoline-3-carbonitrile Traditional Name: 8-bromo-4-(3-chloro-4-fluoro-anilino)-6-[(2-methylpyrazol-3-yl)methylamino]quinoline-3-carbonitrile Formula: C21H15BrClFN6 MolecularWeight: 485.739403

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)CNC2=CC(=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=C(C=C4)F)Cl)Br

Isomeric SMILES

CN1C(=CC=N1)CNC2=CC(=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=C(C=C4)F)Cl)Br

InChI

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