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

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]propane-1-thiol Openeye Name: 3-(4-benzylpiperazin-1-yl)propane-1-thiol CAS Name: 3-[4-(phenylmethyl)-1-piperazinyl]-1-propanethiol IUPAC Name: 3-(4-benzylpiperazin-1-yl)propane-1-thiol Traditional Name: 3-(4-benzylpiperazino)propane-1-thiol Formula: C14H22N2S MolecularWeight: 250.40288

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCS)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CCCS)CC2=CC=CC=C2

InChI

InChI=1S/C14H22N2S/c17-12-4-7-15-8-10-16(11-9-15)13-14-5-2-1-3-6-14/h1-3,5-6,17H,4,7-13H2