S1,S4-bis[(4-tert-butyl-2,6-dimethyl-3-oxidanyl-phenyl)methyl] benzene-1,4-dicarbothioate

Systemtic Name: S1,S4-bis[(4-tert-butyl-2,6-dimethyl-3-oxidanyl-phenyl)methyl] benzene-1,4-dicarbothioate Openeye Name: S1,S4-bis[(4-tert-butyl-3-hydroxy-2,6-dimethyl-phenyl)methyl] benzene-1,4-dicarbothioate CAS Name: benzene-1,4-dicarbothioic acid S1,S4-bis[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methyl] ester IUPAC Name: 1-S,4-S-bis[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methyl] benzene-1,4-dicarbothioate Traditional Name: benzene-1,4-dicarbothioic acid S1,S4-bis(4-tert-butyl-3-hydroxy-2,6-dimethyl-benzyl) ester Formula: C34H42O4S2 MolecularWeight: 578.82488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CSC(=O)C2=CC=C(C=C2)C(=O)SCC3=C(C(=C(C=C3C)C(C)(C)C)O)C)C)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1CSC(=O)C2=CC=C(C=C2)C(=O)SCC3=C(C(=C(C=C3C)C(C)(C)C)O)C)C)O)C(C)(C)C

InChI

InChI=1S/C34H42O4S2/c1-19-15-27(33(5,6)7)29(35)21(3)25(19)17-39-31(37)23-11-13-24(14-12-23)32(38)40-18-26-20(2)16-28(34(8,9)10)30(36)22(26)4/h11-16,35-36H,17-18H2,1-10H3