5-[4-[(4-octylphenyl)diazenyl]phenoxy]pentane-1-thiol

Systemtic Name: 5-[4-[(4-octylphenyl)diazenyl]phenoxy]pentane-1-thiol Openeye Name: 5-[4-(4-octylphenyl)azophenoxy]pentane-1-thiol CAS Name: 5-[4-(4-octylphenyl)azophenoxy]-1-pentanethiol IUPAC Name: 5-[4-[(4-octylphenyl)diazenyl]phenoxy]pentane-1-thiol Traditional Name: 5-[4-(4-octylphenyl)azophenoxy]pentane-1-thiol Formula: C25H36N2OS MolecularWeight: 412.63114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCCS

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCCS

InChI

InChI=1S/C25H36N2OS/c1-2-3-4-5-6-8-11-22-12-14-23(15-13-22)26-27-24-16-18-25(19-17-24)28-20-9-7-10-21-29/h12-19,29H,2-11,20-21H2,1H3