bis[6-tert-butyl-4-methyl-2-sulfanyl-3-(sulfanylmethyl)phenyl] benzene-1,4-dicarboxylate

Systemtic Name: bis[6-tert-butyl-4-methyl-2-sulfanyl-3-(sulfanylmethyl)phenyl] benzene-1,4-dicarboxylate Openeye Name: bis[6-tert-butyl-4-methyl-2-sulfanyl-3-(sulfanylmethyl)phenyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis[6-tert-butyl-2-mercapto-3-(mercaptomethyl)-4-methylphenyl] ester IUPAC Name: bis[6-tert-butyl-4-methyl-2-sulfanyl-3-(sulfanylmethyl)phenyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis[6-tert-butyl-2-mercapto-3-(mercaptomethyl)-4-methyl-phenyl] ester Formula: C32H38O4S4 MolecularWeight: 614.90172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CS)S)OC(=O)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C(=C3S)CS)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1CS)S)OC(=O)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C(=C3S)CS)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C32H38O4S4/c1-17-13-23(31(3,4)5)25(27(39)21(17)15-37)35-29(33)19-9-11-20(12-10-19)30(34)36-26-24(32(6,7)8)14-18(2)22(16-38)28(26)40/h9-14,37-40H,15-16H2,1-8H3