1-phenylmethoxy-3-[4-(phenylmethyl)piperazin-1-yl]propane-2-thiol

Systemtic Name: 1-phenylmethoxy-3-[4-(phenylmethyl)piperazin-1-yl]propane-2-thiol Openeye Name: 1-benzyloxy-3-(4-benzylpiperazin-1-yl)propane-2-thiol CAS Name: 1-phenylmethoxy-3-[4-(phenylmethyl)-1-piperazinyl]-2-propanethiol IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-phenylmethoxypropane-2-thiol Traditional Name: 1-benzoxy-3-(4-benzylpiperazino)propane-2-thiol Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(COCC3=CC=CC=C3)S

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(COCC3=CC=CC=C3)S

InChI

InChI=1S/C21H28N2OS/c25-21(18-24-17-20-9-5-2-6-10-20)16-23-13-11-22(12-14-23)15-19-7-3-1-4-8-19/h1-10,21,25H,11-18H2