2-[4,6-bis(2-phenyl-2-sulfanyl-ethyl)-1,3,5-trioxan-2-yl]-1-phenyl-ethanethiol

Systemtic Name: 2-[4,6-bis(2-phenyl-2-sulfanyl-ethyl)-1,3,5-trioxan-2-yl]-1-phenyl-ethanethiol Openeye Name: 2-[4,6-bis(2-phenyl-2-sulfanyl-ethyl)-1,3,5-trioxan-2-yl]-1-phenyl-ethanethiol CAS Name: 2-[4,6-bis(2-mercapto-2-phenylethyl)-1,3,5-trioxan-2-yl]-1-phenylethanethiol IUPAC Name: 2-[4,6-bis(2-phenyl-2-sulfanylethyl)-1,3,5-trioxan-2-yl]-1-phenylethanethiol Traditional Name: 2-[4,6-bis(2-mercapto-2-phenyl-ethyl)-1,3,5-trioxan-2-yl]-1-phenyl-ethanethiol Formula: C27H30O3S3 MolecularWeight: 498.7203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC2OC(OC(O2)CC(C3=CC=CC=C3)S)CC(C4=CC=CC=C4)S)S

Isomeric SMILES

C1=CC=C(C=C1)C(CC2OC(OC(O2)CC(C3=CC=CC=C3)S)CC(C4=CC=CC=C4)S)S

InChI

InChI=1S/C27H30O3S3/c31-22(19-10-4-1-5-11-19)16-25-28-26(17-23(32)20-12-6-2-7-13-20)30-27(29-25)18-24(33)21-14-8-3-9-15-21/h1-15,22-27,31-33H,16-18H2