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

Systemtic Name: 5-butyl-2-[2-[4-(2-fluoranyl-4-propoxy-phenyl)phenyl]ethyl]-1,3-dithiane Openeye Name: 5-butyl-2-[2-[4-(2-fluoro-4-propoxy-phenyl)phenyl]ethyl]-1,3-dithiane CAS Name: 5-butyl-2-[2-[4-(2-fluoro-4-propoxyphenyl)phenyl]ethyl]-1,3-dithiane IUPAC Name: 5-butyl-2-[2-[4-(2-fluoro-4-propoxyphenyl)phenyl]ethyl]-1,3-dithiane Traditional Name: 5-butyl-2-[2-[4-(2-fluoro-4-propoxy-phenyl)phenyl]ethyl]-1,3-dithiane Formula: C25H33FOS2 MolecularWeight: 432.657323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33FOS2/c1-3-5-6-20-17-28-25(29-18-20)14-9-19-7-10-21(11-8-19)23-13-12-22(16-24(23)26)27-15-4-2/h7-8,10-13,16,20,25H,3-6,9,14-15,17-18H2,1-2H3