2-[5-(2-methylsulfanylethyl)-3,6-bis(oxidanylidene)piperazin-2-yl]ethanoic acid

Systemtic Name: 2-[5-(2-methylsulfanylethyl)-3,6-bis(oxidanylidene)piperazin-2-yl]ethanoic acid Openeye Name: 2-[5-(2-methylsulfanylethyl)-3,6-dioxo-piperazin-2-yl]acetic acid CAS Name: 2-[5-[2-(methylthio)ethyl]-3,6-dioxo-2-piperazinyl]acetic acid IUPAC Name: 2-[5-(2-methylsulfanylethyl)-3,6-dioxopiperazin-2-yl]acetic acid Traditional Name: 2-[3,6-diketo-5-[2-(methylthio)ethyl]piperazin-2-yl]acetic acid Formula: C9H14N2O4S MolecularWeight: 246.28346

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC1C(=O)NC(C(=O)N1)CC(=O)O

Isomeric SMILES

CSCCC1C(=O)NC(C(=O)N1)CC(=O)O

InChI

InChI=1S/C9H14N2O4S/c1-16-3-2-5-8(14)11-6(4-7(12)13)9(15)10-5/h5-6H,2-4H2,1H3,(H,10,15)(H,11,14)(H,12,13)