3-[4-[[5-fluoranyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-piperidin-4-ylidene-methyl]phenyl]benzenecarbonitrile

Systemtic Name: 3-[4-[[5-fluoranyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-piperidin-4-ylidene-methyl]phenyl]benzenecarbonitrile Openeye Name: 3-[4-[[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-(4-piperidylidene)methyl]phenyl]benzonitrile CAS Name: 3-[4-[[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-(4-piperidinylidene)methyl]phenyl]benzonitrile IUPAC Name: 3-[4-[[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-piperidin-4-ylidenemethyl]phenyl]benzonitrile Traditional Name: 3-[4-[[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-(4-piperidylidene)methyl]phenyl]benzonitrile Formula: C27H20F4N4 MolecularWeight: 476.468113

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1=C(C2=CC=C(C=C2)C3=CC=CC(=C3)C#N)C4=NC5=C(N4)C=C(C(=C5)F)C(F)(F)F

Isomeric SMILES

C1CNCCC1=C(C2=CC=C(C=C2)C3=CC=CC(=C3)C#N)C4=NC5=C(N4)C=C(C(=C5)F)C(F)(F)F

InChI

InChI=1S/C27H20F4N4/c28-22-14-24-23(13-21(22)27(29,30)31)34-26(35-24)25(19-8-10-33-11-9-19)18-6-4-17(5-7-18)20-3-1-2-16(12-20)15-32/h1-7,12-14,33H,8-11H2,(H,34,35)