1-(4-ethanoylsulfanylbutanoyl)-4-methyl-piperazine-2-carboxylic acid

Systemtic Name: 1-(4-ethanoylsulfanylbutanoyl)-4-methyl-piperazine-2-carboxylic acid Openeye Name: 1-(4-acetylsulfanylbutanoyl)-4-methyl-piperazine-2-carboxylic acid CAS Name: 1-[4-(acetylthio)-1-oxobutyl]-4-methyl-2-piperazinecarboxylic acid IUPAC Name: 1-(4-acetylsulfanylbutanoyl)-4-methylpiperazine-2-carboxylic acid Traditional Name: 1-[4-(acetylthio)butanoyl]-4-methyl-piperazine-2-carboxylic acid Formula: C12H20N2O4S MolecularWeight: 288.3632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCC(=O)N1CCN(CC1C(=O)O)C

Isomeric SMILES

CC(=O)SCCCC(=O)N1CCN(CC1C(=O)O)C

InChI

InChI=1S/C12H20N2O4S/c1-9(15)19-7-3-4-11(16)14-6-5-13(2)8-10(14)12(17)18/h10H,3-8H2,1-2H3,(H,17,18)