4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]benzenecarbonitrile Openeye Name: 4-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]benzonitrile CAS Name: 4-[4-(3-chloro-4-fluoroanilino)-6-quinazolinyl]benzonitrile IUPAC Name: 4-[4-(3-chloro-4-fluoroanilino)quinazolin-6-yl]benzonitrile Traditional Name: 4-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]benzonitrile Formula: C21H12ClFN4 MolecularWeight: 374.798183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H12ClFN4/c22-18-10-16(6-7-19(18)23)27-21-17-9-15(5-8-20(17)25-12-26-21)14-3-1-13(11-24)2-4-14/h1-10,12H,(H,25,26,27)