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

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(p-tolylmethylsulfanyl)ethyl]acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[2-[(4-methylphenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-[(4-methylbenzyl)thio]ethyl]acetamide Formula: C18H28N3O2S+ MolecularWeight: 350.49882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2S/c1-15-3-5-17(6-4-15)14-24-12-7-19-18(23)13-20-8-10-21(11-9-20)16(2)22/h3-6H,7-14H2,1-2H3,(H,19,23)/p+1