S-[2-acetamido-3-(2-ethanoylsulfanylethylamino)-3-oxidanylidene-propyl] 2-methylpropanethioate

Systemtic Name: S-[2-acetamido-3-(2-ethanoylsulfanylethylamino)-3-oxidanylidene-propyl] 2-methylpropanethioate Openeye Name: S-[2-acetamido-3-(2-acetylsulfanylethylamino)-3-oxo-propyl] 2-methylpropanethioate CAS Name: 2-methylpropanethioic acid S-[2-acetamido-3-[2-(acetylthio)ethylamino]-3-oxopropyl] ester IUPAC Name: S-[2-acetamido-3-(2-acetylsulfanylethylamino)-3-oxopropyl] 2-methylpropanethioate Traditional Name: 2-methylpropanethioic acid S-[2-acetamido-3-[2-(acetylthio)ethylamino]-3-keto-propyl] ester Formula: C13H22N2O4S2 MolecularWeight: 334.45478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)SCC(C(=O)NCCSC(=O)C)NC(=O)C

Isomeric SMILES

CC(C)C(=O)SCC(C(=O)NCCSC(=O)C)NC(=O)C

InChI

InChI=1S/C13H22N2O4S2/c1-8(2)13(19)21-7-11(15-9(3)16)12(18)14-5-6-20-10(4)17/h8,11H,5-7H2,1-4H3,(H,14,18)(H,15,16)