1,3,5-tris(3-dodecylsulfanyl-2-oxidanyl-propyl)-1,3,5-triazinane-2,4,6-trione

Systemtic Name: 1,3,5-tris(3-dodecylsulfanyl-2-oxidanyl-propyl)-1,3,5-triazinane-2,4,6-trione Openeye Name: 1,3,5-tris(3-dodecylsulfanyl-2-hydroxy-propyl)-1,3,5-triazinane-2,4,6-trione CAS Name: 1,3,5-tris[3-(dodecylthio)-2-hydroxypropyl]-1,3,5-triazinane-2,4,6-trione IUPAC Name: 1,3,5-tris(3-dodecylsulfanyl-2-hydroxypropyl)-1,3,5-triazinane-2,4,6-trione Traditional Name: 1,3,5-tris[2-hydroxy-3-(laurylthio)propyl]isocyanuric acid Formula: C48H93N3O6S3 MolecularWeight: 904.46352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(CN1C(=O)N(C(=O)N(C1=O)CC(CSCCCCCCCCCCCC)O)CC(CSCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCSCC(CN1C(=O)N(C(=O)N(C1=O)CC(CSCCCCCCCCCCCC)O)CC(CSCCCCCCCCCCCC)O)O

InChI

InChI=1S/C48H93N3O6S3/c1-4-7-10-13-16-19-22-25-28-31-34-58-40-43(52)37-49-46(55)50(38-44(53)41-59-35-32-29-26-23-20-17-14-11-8-5-2)48(57)51(47(49)56)39-45(54)42-60-36-33-30-27-24-21-18-15-12-9-6-3/h43-45,52-54H,4-42H2,1-3H3