[2,2-bis(3-sulfanylpropanoyloxymethyl)-3-[3-(3-triethoxysilylpropylcarbamoylsulfanyl)propanoyloxy]propyl] 3-sulfanylpropanoate

Systemtic Name: [2,2-bis(3-sulfanylpropanoyloxymethyl)-3-[3-(3-triethoxysilylpropylcarbamoylsulfanyl)propanoyloxy]propyl] 3-sulfanylpropanoate Openeye Name: [2,2-bis(3-sulfanylpropanoyloxymethyl)-3-[3-(3-triethoxysilylpropylcarbamoylsulfanyl)propanoyloxy]propyl] 3-sulfanylpropanoate CAS Name: 3-mercaptopropanoic acid [2,2-bis[(3-mercapto-1-oxopropoxy)methyl]-3-[1-oxo-3-[[oxo-(3-triethoxysilylpropylamino)methyl]thio]propoxy]propyl] ester IUPAC Name: [2,2-bis(3-sulfanylpropanoyloxymethyl)-3-[3-(3-triethoxysilylpropylcarbamoylsulfanyl)propanoyloxy]propyl] 3-sulfanylpropanoate Traditional Name: 3-mercaptopropionic acid [2,2-bis(3-mercaptopropanoyloxymethyl)-3-[3-(3-triethoxysilylpropylcarbamoylthio)propanoyloxy]propyl] ester Formula: C27H49NO12S4Si MolecularWeight: 736.02296

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Descriptors Computed from Structure

Canonical SMILES:

CCO[Si](CCCNC(=O)SCCC(=O)OCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS)(OCC)OCC

Isomeric SMILES

CCO[Si](CCCNC(=O)SCCC(=O)OCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS)(OCC)OCC

InChI

InChI=1S/C27H49NO12S4Si/c1-4-38-45(39-5-2,40-6-3)17-7-12-28-26(33)44-16-11-25(32)37-21-27(18-34-22(29)8-13-41,19-35-23(30)9-14-42)20-36-24(31)10-15-43/h41-43H,4-21H2,1-3H3,(H,28,33)