[3-[(2S)-2-phenyl-2-sulfanyl-ethanoyl]oxy-2,2-bis[(2-phenyl-2-sulfanyl-ethanoyl)oxymethyl]propyl] 2-phenyl-2-sulfanyl-ethanoate

Systemtic Name: [3-[(2S)-2-phenyl-2-sulfanyl-ethanoyl]oxy-2,2-bis[(2-phenyl-2-sulfanyl-ethanoyl)oxymethyl]propyl] 2-phenyl-2-sulfanyl-ethanoate Openeye Name: [3-[(2S)-2-phenyl-2-sulfanyl-acetyl]oxy-2,2-bis[(2-phenyl-2-sulfanyl-acetyl)oxymethyl]propyl] 2-phenyl-2-sulfanyl-acetate CAS Name: 2-mercapto-2-phenylacetic acid [3-[(2S)-2-mercapto-1-oxo-2-phenylethoxy]-2,2-bis[(2-mercapto-1-oxo-2-phenylethoxy)methyl]propyl] ester IUPAC Name: [3-[(2S)-2-phenyl-2-sulfanylacetyl]oxy-2,2-bis[(2-phenyl-2-sulfanylacetyl)oxymethyl]propyl] 2-phenyl-2-sulfanylacetate Traditional Name: 2-mercapto-2-phenyl-acetic acid [3-[(2S)-2-mercapto-2-phenyl-acetyl]oxy-2,2-bis[(2-mercapto-2-phenyl-acetyl)oxymethyl]propyl] ester Formula: C37H36O8S4 MolecularWeight: 736.93694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)OCC(COC(=O)C(C2=CC=CC=C2)S)(COC(=O)C(C3=CC=CC=C3)S)COC(=O)C(C4=CC=CC=C4)S)S

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)OCC(COC(=O)C(C2=CC=CC=C2)S)(COC(=O)C(C3=CC=CC=C3)S)COC(=O)C(C4=CC=CC=C4)S)S

InChI

InChI=1S/C37H36O8S4/c38-33(29(46)25-13-5-1-6-14-25)42-21-37(22-43-34(39)30(47)26-15-7-2-8-16-26,23-44-35(40)31(48)27-17-9-3-10-18-27)24-45-36(41)32(49)28-19-11-4-12-20-28/h1-20,29-32,46-49H,21-24H2/t29-,30?,31?,32?,37?/m0/s1