3-(3,5-dimethylphenoxy)propane-1-thiol

Systemtic Name: 3-(3,5-dimethylphenoxy)propane-1-thiol Openeye Name: 3-(3,5-dimethylphenoxy)propane-1-thiol CAS Name: 3-(3,5-dimethylphenoxy)-1-propanethiol IUPAC Name: 3-(3,5-dimethylphenoxy)propane-1-thiol Traditional Name: 3-(3,5-dimethylphenoxy)propane-1-thiol Formula: C11H16OS MolecularWeight: 196.30914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCS)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCS)C

InChI

InChI=1S/C11H16OS/c1-9-6-10(2)8-11(7-9)12-4-3-5-13/h6-8,13H,3-5H2,1-2H3