3-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylpropane-1-thiol

Systemtic Name: 3-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylpropane-1-thiol Openeye Name: 3-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylpropane-1-thiol CAS Name: 3-[[4-(1,3-benzodioxol-5-yl)-1-piperazinyl]sulfonyl]-1-propanethiol IUPAC Name: 3-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylpropane-1-thiol Traditional Name: 3-[4-(1,3-benzodioxol-5-yl)piperazino]sulfonylpropane-1-thiol Formula: C14H20N2O4S2 MolecularWeight: 344.4496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)OCO3)S(=O)(=O)CCCS

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)OCO3)S(=O)(=O)CCCS

InChI

InChI=1S/C14H20N2O4S2/c17-22(18,9-1-8-21)16-6-4-15(5-7-16)12-2-3-13-14(10-12)20-11-19-13/h2-3,10,21H,1,4-9,11H2