5,5-bis(ethylsulfanyl)-4-(4-methoxyphenyl)-6,6-diphenyl-hexane-1,2,3,4-tetrol

Systemtic Name: 5,5-bis(ethylsulfanyl)-4-(4-methoxyphenyl)-6,6-diphenyl-hexane-1,2,3,4-tetrol Openeye Name: 5,5-bis(ethylsulfanyl)-4-(4-methoxyphenyl)-6,6-diphenyl-hexane-1,2,3,4-tetrol CAS Name: 5,5-bis(ethylthio)-4-(4-methoxyphenyl)-6,6-diphenylhexane-1,2,3,4-tetrol IUPAC Name: 5,5-bis(ethylsulfanyl)-4-(4-methoxyphenyl)-6,6-diphenylhexane-1,2,3,4-tetrol Traditional Name: 5,5-bis(ethylthio)-4-(4-methoxyphenyl)-6,6-diphenyl-hexane-1,2,3,4-tetrol Formula: C29H36O5S2 MolecularWeight: 528.72314

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C(C1=CC=CC=C1)C2=CC=CC=C2)(C(C3=CC=C(C=C3)OC)(C(C(CO)O)O)O)SCC

Isomeric SMILES

CCSC(C(C1=CC=CC=C1)C2=CC=CC=C2)(C(C3=CC=C(C=C3)OC)(C(C(CO)O)O)O)SCC

InChI

InChI=1S/C29H36O5S2/c1-4-35-29(36-5-2,26(21-12-8-6-9-13-21)22-14-10-7-11-15-22)28(33,27(32)25(31)20-30)23-16-18-24(34-3)19-17-23/h6-19,25-27,30-33H,4-5,20H2,1-3H3