2-[(2S)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-methylsulfanylpropyl)ethanamide

Systemtic Name: 2-[(2S)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-methylsulfanylpropyl)ethanamide Openeye Name: 2-[(2S)-1-cyclopentyl-3-oxo-piperazin-1-ium-2-yl]-N-(3-methylsulfanylpropyl)acetamide CAS Name: 2-[(2S)-1-cyclopentyl-3-oxo-2-piperazin-1-iumyl]-N-[3-(methylthio)propyl]acetamide IUPAC Name: 2-[(2S)-1-cyclopentyl-3-oxopiperazin-1-ium-2-yl]-N-(3-methylsulfanylpropyl)acetamide Traditional Name: 2-[(2S)-1-cyclopentyl-3-keto-piperazin-1-ium-2-yl]-N-[3-(methylthio)propyl]acetamide Formula: C15H28N3O2S+ MolecularWeight: 314.46672

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=O)CC1C(=O)NCC[NH+]1C2CCCC2

Isomeric SMILES

CSCCCNC(=O)C[C@H]1C(=O)NCC[NH+]1C2CCCC2

InChI

InChI=1S/C15H27N3O2S/c1-21-10-4-7-16-14(19)11-13-15(20)17-8-9-18(13)12-5-2-3-6-12/h12-13H,2-11H2,1H3,(H,16,19)(H,17,20)/p+1/t13-/m0/s1