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

Systemtic Name: 4-chloranyl-2-[4-[2-(1H-imidazol-5-yl)ethylamino]-1-phenyl-butoxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[4-[2-(1H-imidazol-5-yl)ethylamino]-1-phenyl-butoxy]benzonitrile CAS Name: 4-chloro-2-[4-[2-(1H-imidazol-5-yl)ethylamino]-1-phenylbutoxy]benzonitrile IUPAC Name: 4-chloro-2-[4-[2-(1H-imidazol-5-yl)ethylamino]-1-phenylbutoxy]benzonitrile Traditional Name: 4-chloro-2-[4-[2-(1H-imidazol-5-yl)ethylamino]-1-phenyl-butoxy]benzonitrile Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCNCCC2=CN=CN2)OC3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCCNCCC2=CN=CN2)OC3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C22H23ClN4O/c23-19-9-8-18(14-24)22(13-19)28-21(17-5-2-1-3-6-17)7-4-11-25-12-10-20-15-26-16-27-20/h1-3,5-6,8-9,13,15-16,21,25H,4,7,10-12H2,(H,26,27)