2-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(4-acetyl-1-piperazinyl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-(4-acetylpiperazino)-2-keto-ethyl]thio]propionic acid Formula: C11H18N2O4S MolecularWeight: 274.33662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)N1CCN(CC1)C(=O)C

Isomeric SMILES

CC(C(=O)O)SCC(=O)N1CCN(CC1)C(=O)C

InChI

InChI=1S/C11H18N2O4S/c1-8(11(16)17)18-7-10(15)13-5-3-12(4-6-13)9(2)14/h8H,3-7H2,1-2H3,(H,16,17)