3-[4-(phenylmethyl)piperazin-1-yl]sulfonylpropane-1-thiol

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]sulfonylpropane-1-thiol Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonylpropane-1-thiol CAS Name: 3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-1-propanethiol IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonylpropane-1-thiol Traditional Name: 3-(4-benzylpiperazino)sulfonylpropane-1-thiol Formula: C14H22N2O2S2 MolecularWeight: 314.46668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)CCCS

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)CCCS

InChI

InChI=1S/C14H22N2O2S2/c17-20(18,12-4-11-19)16-9-7-15(8-10-16)13-14-5-2-1-3-6-14/h1-3,5-6,19H,4,7-13H2