2-(4-ethanoylpiperazin-1-ium-1-yl)-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[2-[(4-methylphenyl)thio]ethyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(p-tolylthio)ethyl]acetamide Formula: C17H26N3O2S+ MolecularWeight: 336.47224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C17H25N3O2S/c1-14-3-5-16(6-4-14)23-12-7-18-17(22)13-19-8-10-20(11-9-19)15(2)21/h3-6H,7-13H2,1-2H3,(H,18,22)/p+1