2-[4-[4-(4-butylcyclohexyl)-2-fluoranyl-phenyl]phenyl]-5-pentyl-1,3-dithiane

Systemtic Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluoranyl-phenyl]phenyl]-5-pentyl-1,3-dithiane Openeye Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluoro-phenyl]phenyl]-5-pentyl-1,3-dithiane CAS Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluorophenyl]phenyl]-5-pentyl-1,3-dithiane IUPAC Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluorophenyl]phenyl]-5-pentyl-1,3-dithiane Traditional Name: 5-amyl-2-[4-[4-(4-butylcyclohexyl)-2-fluoro-phenyl]phenyl]-1,3-dithiane Formula: C31H43FS2 MolecularWeight: 498.801523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CSC(SC1)C2=CC=C(C=C2)C3=C(C=C(C=C3)C4CCC(CC4)CCCC)F

Isomeric SMILES

CCCCCC1CSC(SC1)C2=CC=C(C=C2)C3=C(C=C(C=C3)C4CCC(CC4)CCCC)F

InChI

InChI=1S/C31H43FS2/c1-3-5-7-9-24-21-33-31(34-22-24)27-16-14-26(15-17-27)29-19-18-28(20-30(29)32)25-12-10-23(11-13-25)8-6-4-2/h14-20,23-25,31H,3-13,21-22H2,1-2H3