O-[3-(4-methyl-4-phenyl-pentanethioyl)oxy-2,2-bis[(4-methyl-4-phenyl-pentanethioyl)oxymethyl]propyl] 4-methyl-4-phenyl-pentanethioate

Systemtic Name: O-[3-(4-methyl-4-phenyl-pentanethioyl)oxy-2,2-bis[(4-methyl-4-phenyl-pentanethioyl)oxymethyl]propyl] 4-methyl-4-phenyl-pentanethioate Openeye Name: O-[3-(4-methyl-4-phenyl-pentanethioyl)oxy-2,2-bis[(4-methyl-4-phenyl-pentanethioyl)oxymethyl]propyl] 4-methyl-4-phenyl-pentanethioate CAS Name: 4-methyl-4-phenylpentanethioic acid O-[3-(4-methyl-4-phenyl-1-sulfanylidenepentoxy)-2,2-bis[(4-methyl-4-phenyl-1-sulfanylidenepentoxy)methyl]propyl] ester IUPAC Name: O-[3-(4-methyl-4-phenylpentanethioyl)oxy-2,2-bis[(4-methyl-4-phenylpentanethioyl)oxymethyl]propyl] 4-methyl-4-phenylpentanethioate Traditional Name: 4-methyl-4-phenyl-pentanethioic acid O-[3-(4-methyl-4-phenyl-pentanethioyl)oxy-2,2-bis[(4-methyl-4-phenyl-pentanethioyl)oxymethyl]propyl] ester Formula: C53H68O4S4 MolecularWeight: 897.36462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C53H68O4S4/c1-49(2,41-21-13-9-14-22-41)33-29-45(58)54-37-53(38-55-46(59)30-34-50(3,4)42-23-15-10-16-24-42,39-56-47(60)31-35-51(5,6)43-25-17-11-18-26-43)40-57-48(61)32-36-52(7,8)44-27-19-12-20-28-44/h9-28H,29-40H2,1-8H3