2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-[3-(phenylthio)propyl]acetamide Formula: C24H33N3OS+2 MolecularWeight: 411.60332

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC=CC2=CC=CC=C2)CC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC[NH+]1C/C=C/C2=CC=CC=C2)CC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C24H31N3OS/c28-24(25-14-8-20-29-23-12-5-2-6-13-23)21-27-18-16-26(17-19-27)15-7-11-22-9-3-1-4-10-22/h1-7,9-13H,8,14-21H2,(H,25,28)/p+2/b11-7+