3-(2-methylsulfanylethyl)-6-(1-phenylethyl)piperazine-2,5-dione

Systemtic Name: 3-(2-methylsulfanylethyl)-6-(1-phenylethyl)piperazine-2,5-dione Openeye Name: 3-(2-methylsulfanylethyl)-6-(1-phenylethyl)piperazine-2,5-dione CAS Name: 3-[2-(methylthio)ethyl]-6-(1-phenylethyl)piperazine-2,5-dione IUPAC Name: 3-(2-methylsulfanylethyl)-6-(1-phenylethyl)piperazine-2,5-dione Traditional Name: 3-[2-(methylthio)ethyl]-6-(1-phenylethyl)piperazine-2,5-quinone Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)NC(C(=O)N1)CCSC)C2=CC=CC=C2

Isomeric SMILES

CC(C1C(=O)NC(C(=O)N1)CCSC)C2=CC=CC=C2

InChI

InChI=1S/C15H20N2O2S/c1-10(11-6-4-3-5-7-11)13-15(19)16-12(8-9-20-2)14(18)17-13/h3-7,10,12-13H,8-9H2,1-2H3,(H,16,19)(H,17,18)