5-butyl-2-[2-[4-(2-fluoranyl-4-propyl-phenyl)phenyl]ethyl]-1,3-dithiane

Systemtic Name: 5-butyl-2-[2-[4-(2-fluoranyl-4-propyl-phenyl)phenyl]ethyl]-1,3-dithiane Openeye Name: 5-butyl-2-[2-[4-(2-fluoro-4-propyl-phenyl)phenyl]ethyl]-1,3-dithiane CAS Name: 5-butyl-2-[2-[4-(2-fluoro-4-propylphenyl)phenyl]ethyl]-1,3-dithiane IUPAC Name: 5-butyl-2-[2-[4-(2-fluoro-4-propylphenyl)phenyl]ethyl]-1,3-dithiane Traditional Name: 5-butyl-2-[2-[4-(2-fluoro-4-propyl-phenyl)phenyl]ethyl]-1,3-dithiane Formula: C25H33FS2 MolecularWeight: 416.657923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CSC(SC1)CCC2=CC=C(C=C2)C3=C(C=C(C=C3)CCC)F

Isomeric SMILES

CCCCC1CSC(SC1)CCC2=CC=C(C=C2)C3=C(C=C(C=C3)CCC)F

InChI

InChI=1S/C25H33FS2/c1-3-5-7-21-17-27-25(28-18-21)15-11-19-8-12-22(13-9-19)23-14-10-20(6-4-2)16-24(23)26/h8-10,12-14,16,21,25H,3-7,11,15,17-18H2,1-2H3