N-[2-(phenylmethylsulfanyl)ethyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-[4-[(E)-cinnamyl]piperazin-1-yl]acetamide CAS Name: N-[2-(phenylmethylthio)ethyl]-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-[4-[(E)-cinnamyl]piperazino]acetamide Formula: C24H31N3OS MolecularWeight: 409.58744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)CC(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)CC(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3OS/c28-24(25-13-19-29-21-23-10-5-2-6-11-23)20-27-17-15-26(16-18-27)14-7-12-22-8-3-1-4-9-22/h1-12H,13-21H2,(H,25,28)/b12-7+