4-chloranyl-5-fluoranyl-2-[3-[2-(1H-imidazol-5-yl)ethylamino]-1-phenyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-5-fluoranyl-2-[3-[2-(1H-imidazol-5-yl)ethylamino]-1-phenyl-propoxy]benzenecarbonitrile Openeye Name: 4-chloro-5-fluoro-2-[3-[2-(1H-imidazol-5-yl)ethylamino]-1-phenyl-propoxy]benzonitrile CAS Name: 4-chloro-5-fluoro-2-[3-[2-(1H-imidazol-5-yl)ethylamino]-1-phenylpropoxy]benzonitrile IUPAC Name: 4-chloro-5-fluoro-2-[3-[2-(1H-imidazol-5-yl)ethylamino]-1-phenylpropoxy]benzonitrile Traditional Name: 4-chloro-5-fluoro-2-[3-[2-(1H-imidazol-5-yl)ethylamino]-1-phenyl-propoxy]benzonitrile Formula: C21H20ClFN4O MolecularWeight: 398.861103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNCCC2=CN=CN2)OC3=CC(=C(C=C3C#N)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CCNCCC2=CN=CN2)OC3=CC(=C(C=C3C#N)F)Cl

InChI

InChI=1S/C21H20ClFN4O/c22-18-11-21(16(12-24)10-19(18)23)28-20(15-4-2-1-3-5-15)7-9-25-8-6-17-13-26-14-27-17/h1-5,10-11,13-14,20,25H,6-9H2,(H,26,27)