2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]ethanamide

Systemtic Name: 2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]ethanamide Openeye Name: 2-[(2R)-1-cyclopentyl-3-oxo-piperazin-1-ium-2-yl]-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]acetamide CAS Name: 2-[(2R)-1-cyclopentyl-3-oxo-2-piperazin-1-iumyl]-N-[2-[(1-methyl-2-imidazolyl)thio]ethyl]acetamide IUPAC Name: 2-[(2R)-1-cyclopentyl-3-oxopiperazin-1-ium-2-yl]-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]acetamide Traditional Name: 2-[(2R)-1-cyclopentyl-3-keto-piperazin-1-ium-2-yl]-N-[2-[(1-methylimidazol-2-yl)thio]ethyl]acetamide Formula: C17H28N5O2S+ MolecularWeight: 366.50152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCNC(=O)CC2C(=O)NCC[NH+]2C3CCCC3

Isomeric SMILES

CN1C=CN=C1SCCNC(=O)C[C@@H]2C(=O)NCC[NH+]2C3CCCC3

InChI

InChI=1S/C17H27N5O2S/c1-21-9-6-20-17(21)25-11-8-18-15(23)12-14-16(24)19-7-10-22(14)13-4-2-3-5-13/h6,9,13-14H,2-5,7-8,10-12H2,1H3,(H,18,23)(H,19,24)/p+1/t14-/m1/s1