3-(4-butan-2-ylsulfanylphenyl)sulfanylpropane-1,2-diol

Systemtic Name: 3-(4-butan-2-ylsulfanylphenyl)sulfanylpropane-1,2-diol Openeye Name: 3-(4-sec-butylsulfanylphenyl)sulfanylpropane-1,2-diol CAS Name: 3-[[4-(butan-2-ylthio)phenyl]thio]propane-1,2-diol IUPAC Name: 3-(4-butan-2-ylsulfanylphenyl)sulfanylpropane-1,2-diol Traditional Name: 3-[[4-(sec-butylthio)phenyl]thio]propane-1,2-diol Formula: C13H20O2S2 MolecularWeight: 272.4267

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=C(C=C1)SCC(CO)O

Isomeric SMILES

CCC(C)SC1=CC=C(C=C1)SCC(CO)O

InChI

InChI=1S/C13H20O2S2/c1-3-10(2)17-13-6-4-12(5-7-13)16-9-11(15)8-14/h4-7,10-11,14-15H,3,8-9H2,1-2H3