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

Systemtic Name: 5-butyl-2-[4-[2-(4-pentylcyclohexyl)ethyl]phenyl]-1,3-dithiane Openeye Name: 5-butyl-2-[4-[2-(4-pentylcyclohexyl)ethyl]phenyl]-1,3-dithiane CAS Name: 5-butyl-2-[4-[2-(4-pentylcyclohexyl)ethyl]phenyl]-1,3-dithiane IUPAC Name: 5-butyl-2-[4-[2-(4-pentylcyclohexyl)ethyl]phenyl]-1,3-dithiane Traditional Name: 2-[4-[2-(4-amylcyclohexyl)ethyl]phenyl]-5-butyl-1,3-dithiane Formula: C27H44S2 MolecularWeight: 432.76826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=CC=C(C=C2)C3SCC(CS3)CCCC

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=CC=C(C=C2)C3SCC(CS3)CCCC

InChI

InChI=1S/C27H44S2/c1-3-5-7-9-22-10-12-23(13-11-22)14-15-24-16-18-26(19-17-24)27-28-20-25(21-29-27)8-6-4-2/h16-19,22-23,25,27H,3-15,20-21H2,1-2H3