S-[2-acetamido-3-[2-(2-methylpropanoylsulfanyl)ethylamino]-3-oxidanylidene-propyl] 2,2-dimethylpropanethioate

Systemtic Name: S-[2-acetamido-3-[2-(2-methylpropanoylsulfanyl)ethylamino]-3-oxidanylidene-propyl] 2,2-dimethylpropanethioate Openeye Name: S-[2-acetamido-3-[2-(2-methylpropanoylsulfanyl)ethylamino]-3-oxo-propyl] 2,2-dimethylpropanethioate CAS Name: 2,2-dimethylpropanethioic acid S-[2-acetamido-3-[2-[(2-methyl-1-oxopropyl)thio]ethylamino]-3-oxopropyl] ester IUPAC Name: S-[2-acetamido-3-[2-(2-methylpropanoylsulfanyl)ethylamino]-3-oxopropyl] 2,2-dimethylpropanethioate Traditional Name: 2,2-dimethylpropanethioic acid S-[2-acetamido-3-[2-(isobutyrylthio)ethylamino]-3-keto-propyl] ester Formula: C16H28N2O4S2 MolecularWeight: 376.53452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)SCCNC(=O)C(CSC(=O)C(C)(C)C)NC(=O)C

Isomeric SMILES

CC(C)C(=O)SCCNC(=O)C(CSC(=O)C(C)(C)C)NC(=O)C

InChI

InChI=1S/C16H28N2O4S2/c1-10(2)14(21)23-8-7-17-13(20)12(18-11(3)19)9-24-15(22)16(4,5)6/h10,12H,7-9H2,1-6H3,(H,17,20)(H,18,19)