2-[3-chloranyl-1-(4-piperidin-4-ylbutyl)indol-4-yl]-6-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: 2-[3-chloranyl-1-(4-piperidin-4-ylbutyl)indol-4-yl]-6-(trifluoromethyl)-1H-benzimidazole Openeye Name: 2-[3-chloro-1-[4-(4-piperidyl)butyl]indol-4-yl]-6-(trifluoromethyl)-1H-benzimidazole CAS Name: 2-[3-chloro-1-[4-(4-piperidinyl)butyl]-4-indolyl]-6-(trifluoromethyl)-1H-benzimidazole IUPAC Name: 2-[3-chloro-1-(4-piperidin-4-ylbutyl)indol-4-yl]-6-(trifluoromethyl)-1H-benzimidazole Traditional Name: 2-[3-chloro-1-[4-(4-piperidyl)butyl]indol-4-yl]-6-(trifluoromethyl)-1H-benzimidazole Formula: C25H26ClF3N4 MolecularWeight: 474.94895

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCCCN2C=C(C3=C(C=CC=C32)C4=NC5=C(N4)C=C(C=C5)C(F)(F)F)Cl

Isomeric SMILES

C1CNCCC1CCCCN2C=C(C3=C(C=CC=C32)C4=NC5=C(N4)C=C(C=C5)C(F)(F)F)Cl

InChI

InChI=1S/C25H26ClF3N4/c26-19-15-33(13-2-1-4-16-9-11-30-12-10-16)22-6-3-5-18(23(19)22)24-31-20-8-7-17(25(27,28)29)14-21(20)32-24/h3,5-8,14-16,30H,1-2,4,9-13H2,(H,31,32)