2-[4-(2-sulfanylpropan-2-yl)phenyl]propane-2-thiol

Systemtic Name: 2-[4-(2-sulfanylpropan-2-yl)phenyl]propane-2-thiol Openeye Name: 2-[4-(1-methyl-1-sulfanyl-ethyl)phenyl]propane-2-thiol CAS Name: 2-[4-(2-mercaptopropan-2-yl)phenyl]-2-propanethiol IUPAC Name: 2-[4-(2-sulfanylpropan-2-yl)phenyl]propane-2-thiol Traditional Name: 2-[4-(1-mercapto-1-methyl-ethyl)phenyl]propane-2-thiol Formula: C12H18S2 MolecularWeight: 226.40132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C(C)(C)S)S

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C(C)(C)S)S

InChI

InChI=1S/C12H18S2/c1-11(2,13)9-5-7-10(8-6-9)12(3,4)14/h5-8,13-14H,1-4H3