5-(2,4-dimethylphenoxy)pentane-1-thiol

Systemtic Name: 5-(2,4-dimethylphenoxy)pentane-1-thiol Openeye Name: 5-(2,4-dimethylphenoxy)pentane-1-thiol CAS Name: 5-(2,4-dimethylphenoxy)-1-pentanethiol IUPAC Name: 5-(2,4-dimethylphenoxy)pentane-1-thiol Traditional Name: 5-(2,4-dimethylphenoxy)pentane-1-thiol Formula: C13H20OS MolecularWeight: 224.3623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCCCS)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCCCS)C

InChI

InChI=1S/C13H20OS/c1-11-6-7-13(12(2)10-11)14-8-4-3-5-9-15/h6-7,10,15H,3-5,8-9H2,1-2H3