[2,6-bis(tert-butylsulfanyl)-3,5-bis(phenylcarbonyloxy)thian-4-yl] benzoate

Systemtic Name: [2,6-bis(tert-butylsulfanyl)-3,5-bis(phenylcarbonyloxy)thian-4-yl] benzoate Openeye Name: [3,5-dibenzoyloxy-2,6-bis(tert-butylsulfanyl)tetrahydrothiopyran-4-yl] benzoate CAS Name: benzoic acid [3,5-dibenzoyloxy-2,6-bis(tert-butylthio)-4-thianyl] ester IUPAC Name: [3,5-dibenzoyloxy-2,6-bis(tert-butylsulfanyl)thian-4-yl] benzoate Traditional Name: benzoic acid [3,5-dibenzoyloxy-2,6-bis(tert-butylthio)tetrahydrothiopyran-4-yl] ester Formula: C34H38O6S3 MolecularWeight: 638.85692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1C(C(C(C(S1)SC(C)(C)C)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)SC1C(C(C(C(S1)SC(C)(C)C)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C34H38O6S3/c1-33(2,3)42-31-26(39-29(36)23-18-12-8-13-19-23)25(38-28(35)22-16-10-7-11-17-22)27(32(41-31)43-34(4,5)6)40-30(37)24-20-14-9-15-21-24/h7-21,25-27,31-32H,1-6H3