3-[2,4-bis(fluoranyl)phenyl]-1-[2-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethoxy]ethyl]-1-heptyl-urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-[2-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethoxy]ethyl]-1-heptyl-urea Openeye Name: 3-(2,4-difluorophenyl)-1-[2-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethoxy]ethyl]-1-heptyl-urea CAS Name: 3-(2,4-difluorophenyl)-1-[2-[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]ethoxy]ethyl]-1-heptylurea IUPAC Name: 3-(2,4-difluorophenyl)-1-[2-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethoxy]ethyl]-1-heptylurea Traditional Name: 3-(2,4-difluorophenyl)-1-[2-[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]ethoxy]ethyl]-1-heptyl-urea Formula: C33H38F2N4O2S MolecularWeight: 592.742226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCOCCSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

CCCCCCCN(CCOCCSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C33H38F2N4O2S/c1-2-3-4-5-12-19-39(33(40)36-29-18-17-27(34)24-28(29)35)20-21-41-22-23-42-32-37-30(25-13-8-6-9-14-25)31(38-32)26-15-10-7-11-16-26/h6-11,13-18,24H,2-5,12,19-23H2,1H3,(H,36,40)(H,37,38)