2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-(2-phenylsulfanylethyl)ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-(2-phenylsulfanylethyl)ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(2-phenylsulfanylethyl)acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-N-[2-(phenylthio)ethyl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(2-phenylsulfanylethyl)acetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[2-(phenylthio)ethyl]acetamide Formula: C21H29N3OS+2 MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C21H27N3OS/c25-21(22-11-16-26-20-9-5-2-6-10-20)18-24-14-12-23(13-15-24)17-19-7-3-1-4-8-19/h1-10H,11-18H2,(H,22,25)/p+2