3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propane-1-thiol

Systemtic Name: 3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propane-1-thiol Openeye Name: 3-[2,4-bis(1,1-dimethylpropyl)phenoxy]propane-1-thiol CAS Name: 3-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-propanethiol IUPAC Name: 3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propane-1-thiol Traditional Name: 3-(2,4-ditert-amylphenoxy)propane-1-thiol Formula: C19H32OS MolecularWeight: 308.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCS)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCS)C(C)(C)CC

InChI

InChI=1S/C19H32OS/c1-7-18(3,4)15-10-11-17(20-12-9-13-21)16(14-15)19(5,6)8-2/h10-11,14,21H,7-9,12-13H2,1-6H3