(3S,6S)-3-(2-methylsulfanylethyl)-6-(phenylmethyl)piperazine-2,5-dione

Systemtic Name: (3S,6S)-3-(2-methylsulfanylethyl)-6-(phenylmethyl)piperazine-2,5-dione Openeye Name: (3S,6S)-3-benzyl-6-(2-methylsulfanylethyl)piperazine-2,5-dione CAS Name: (3S,6S)-3-[2-(methylthio)ethyl]-6-(phenylmethyl)piperazine-2,5-dione IUPAC Name: (3S,6S)-3-benzyl-6-(2-methylsulfanylethyl)piperazine-2,5-dione Traditional Name: (3S,6S)-3-benzyl-6-[2-(methylthio)ethyl]piperazine-2,5-quinone Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC1C(=O)NC(C(=O)N1)CC2=CC=CC=C2

Isomeric SMILES

CSCC[C@H]1C(=O)N[C@H](C(=O)N1)CC2=CC=CC=C2

InChI

InChI=1S/C14H18N2O2S/c1-19-8-7-11-13(17)16-12(14(18)15-11)9-10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3,(H,15,18)(H,16,17)/t11-,12-/m0/s1