2-(3-fluoranyl-4-pentyl-phenyl)-5-propyl-1,3-dithiane

Systemtic Name: 2-(3-fluoranyl-4-pentyl-phenyl)-5-propyl-1,3-dithiane Openeye Name: 2-(3-fluoro-4-pentyl-phenyl)-5-propyl-1,3-dithiane CAS Name: 2-(3-fluoro-4-pentylphenyl)-5-propyl-1,3-dithiane IUPAC Name: 2-(3-fluoro-4-pentylphenyl)-5-propyl-1,3-dithiane Traditional Name: 2-(4-amyl-3-fluoro-phenyl)-5-propyl-1,3-dithiane Formula: C18H27FS2 MolecularWeight: 326.535383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C=C1)C2SCC(CS2)CCC)F

Isomeric SMILES

CCCCCC1=C(C=C(C=C1)C2SCC(CS2)CCC)F

InChI

InChI=1S/C18H27FS2/c1-3-5-6-8-15-9-10-16(11-17(15)19)18-20-12-14(7-4-2)13-21-18/h9-11,14,18H,3-8,12-13H2,1-2H3