tert-butyl 3-(1-phenylmethoxyethylsulfanyl)-2,2-bis(1-phenylmethoxyethylsulfanylmethyl)propanoate

Systemtic Name: tert-butyl 3-(1-phenylmethoxyethylsulfanyl)-2,2-bis(1-phenylmethoxyethylsulfanylmethyl)propanoate Openeye Name: tert-butyl 3-(1-benzyloxyethylsulfanyl)-2,2-bis(1-benzyloxyethylsulfanylmethyl)propanoate CAS Name: 3-(1-phenylmethoxyethylthio)-2,2-bis[(1-phenylmethoxyethylthio)methyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(1-phenylmethoxyethylsulfanyl)-2,2-bis(1-phenylmethoxyethylsulfanylmethyl)propanoate Traditional Name: 3-(1-benzoxyethylthio)-2,2-bis[(1-benzoxyethylthio)methyl]propionic acid tert-butyl ester Formula: C36H48O5S3 MolecularWeight: 656.95832

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Descriptors Computed from Structure

Canonical SMILES:

CC(OCC1=CC=CC=C1)SCC(CSC(C)OCC2=CC=CC=C2)(CSC(C)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(OCC1=CC=CC=C1)SCC(CSC(C)OCC2=CC=CC=C2)(CSC(C)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C36H48O5S3/c1-28(38-22-31-16-10-7-11-17-31)42-25-36(34(37)41-35(4,5)6,26-43-29(2)39-23-32-18-12-8-13-19-32)27-44-30(3)40-24-33-20-14-9-15-21-33/h7-21,28-30H,22-27H2,1-6H3