4-bromanyl-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-benzimidazole

Systemtic Name: 4-bromanyl-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-benzimidazole Openeye Name: 4-bromo-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-benzimidazole CAS Name: 4-bromo-6-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-1H-benzimidazole IUPAC Name: 4-bromo-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-benzimidazole Traditional Name: 4-bromo-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]-1H-benzimidazole Formula: C20H20BrF3N4 MolecularWeight: 453.29881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC3=C(C(=C2)Br)N=CN3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCC2=CC3=C(C(=C2)Br)N=CN3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H20BrF3N4/c21-17-10-14(11-18-19(17)26-13-25-18)4-5-27-6-8-28(9-7-27)16-3-1-2-15(12-16)20(22,23)24/h1-3,10-13H,4-9H2,(H,25,26)