2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]-4-chloranyl-benzenecarbonitrile

Systemtic Name: 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]-4-chloranyl-benzenecarbonitrile Openeye Name: 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]-4-chloro-benzonitrile CAS Name: 2-[4-[(2-butyl-1-benzimidazolyl)methyl]phenyl]-4-chlorobenzonitrile IUPAC Name: 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]-4-chlorobenzonitrile Traditional Name: 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]-4-chloro-benzonitrile Formula: C25H22ClN3 MolecularWeight: 399.91528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C4=C(C=CC(=C4)Cl)C#N

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C4=C(C=CC(=C4)Cl)C#N

InChI

InChI=1S/C25H22ClN3/c1-2-3-8-25-28-23-6-4-5-7-24(23)29(25)17-18-9-11-19(12-10-18)22-15-21(26)14-13-20(22)16-27/h4-7,9-15H,2-3,8,17H2,1H3