4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(1,5-dimethylimidazol-4-yl)methylamino]quinoline-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(1,5-dimethylimidazol-4-yl)methylamino]quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-fluoro-anilino)-6-[(1,5-dimethylimidazol-4-yl)methylamino]quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-6-[(1,5-dimethyl-4-imidazolyl)methylamino]-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-fluoroanilino)-6-[(1,5-dimethylimidazol-4-yl)methylamino]quinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)-6-[(1,5-dimethylimidazol-4-yl)methylamino]quinoline-3-carbonitrile Formula: C22H18ClFN6 MolecularWeight: 420.869923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1C)CNC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=C(N=CN1C)CNC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H18ClFN6/c1-13-21(28-12-30(13)2)11-26-15-4-6-20-17(7-15)22(14(9-25)10-27-20)29-16-3-5-19(24)18(23)8-16/h3-8,10,12,26H,11H2,1-2H3,(H,27,29)