(3E)-3-(1-methylsulfanyl-4-oxidanyl-butan-2-ylidene)piperazine-2,5-dione

Systemtic Name: (3E)-3-(1-methylsulfanyl-4-oxidanyl-butan-2-ylidene)piperazine-2,5-dione Openeye Name: (3E)-3-[3-hydroxy-1-(methylsulfanylmethyl)propylidene]piperazine-2,5-dione CAS Name: (3E)-3-[4-hydroxy-1-(methylthio)butan-2-ylidene]piperazine-2,5-dione IUPAC Name: (3E)-3-(4-hydroxy-1-methylsulfanylbutan-2-ylidene)piperazine-2,5-dione Traditional Name: (3E)-3-[3-hydroxy-1-[(methylthio)methyl]propylidene]piperazine-2,5-quinone Formula: C9H14N2O3S MolecularWeight: 230.28406

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=C1C(=O)NCC(=O)N1)CCO

Isomeric SMILES

CSC/C(=C/1\C(=O)NCC(=O)N1)/CCO

InChI

InChI=1S/C9H14N2O3S/c1-15-5-6(2-3-12)8-9(14)10-4-7(13)11-8/h12H,2-5H2,1H3,(H,10,14)(H,11,13)/b8-6+