1-[[3,5-bis(fluoranyl)phenyl]methyl]-2-butylsulfanyl-benzimidazole hydroiodide

Systemtic Name: 1-[[3,5-bis(fluoranyl)phenyl]methyl]-2-butylsulfanyl-benzimidazole hydroiodide Openeye Name: 2-butylsulfanyl-1-[(3,5-difluorophenyl)methyl]benzimidazole hydroiodide CAS Name: 2-(butylthio)-1-[(3,5-difluorophenyl)methyl]benzimidazole hydroiodide IUPAC Name: 2-butylsulfanyl-1-[(3,5-difluorophenyl)methyl]benzimidazole hydroiodide Traditional Name: 2-(butylthio)-1-(3,5-difluorobenzyl)benzimidazole hydroiodide Formula: C18H19F2IN2S MolecularWeight: 460.323136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=CC=CC=C2N1CC3=CC(=CC(=C3)F)F.I

Isomeric SMILES

CCCCSC1=NC2=CC=CC=C2N1CC3=CC(=CC(=C3)F)F.I

InChI

InChI=1S/C18H18F2N2S.HI/c1-2-3-8-23-18-21-16-6-4-5-7-17(16)22(18)12-13-9-14(19)11-15(20)10-13;/h4-7,9-11H,2-3,8,12H2,1H3;1H