1-[5-[2-oxidanyl-3-(4-phenylazanylphenoxy)propyl]sulfanylcyclooctyl]sulfanyl-3-(4-phenylazanylphenoxy)propan-2-ol

Systemtic Name: 1-[5-[2-oxidanyl-3-(4-phenylazanylphenoxy)propyl]sulfanylcyclooctyl]sulfanyl-3-(4-phenylazanylphenoxy)propan-2-ol Openeye Name: 1-(4-anilinophenoxy)-3-[5-[3-(4-anilinophenoxy)-2-hydroxy-propyl]sulfanylcyclooctyl]sulfanyl-propan-2-ol CAS Name: 1-(4-anilinophenoxy)-3-[[5-[[3-(4-anilinophenoxy)-2-hydroxypropyl]thio]cyclooctyl]thio]-2-propanol IUPAC Name: 1-(4-anilinophenoxy)-3-[5-[3-(4-anilinophenoxy)-2-hydroxypropyl]sulfanylcyclooctyl]sulfanylpropan-2-ol Traditional Name: 1-(4-anilinophenoxy)-3-[[5-[[3-(4-anilinophenoxy)-2-hydroxy-propyl]thio]cyclooctyl]thio]propan-2-ol Formula: C38H46N2O4S2 MolecularWeight: 658.91284

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCCC(C1)SCC(COC2=CC=C(C=C2)NC3=CC=CC=C3)O)SCC(COC4=CC=C(C=C4)NC5=CC=CC=C5)O

Isomeric SMILES

C1CC(CCCC(C1)SCC(COC2=CC=C(C=C2)NC3=CC=CC=C3)O)SCC(COC4=CC=C(C=C4)NC5=CC=CC=C5)O

InChI

InChI=1S/C38H46N2O4S2/c41-33(25-43-35-21-17-31(18-22-35)39-29-9-3-1-4-10-29)27-45-37-13-7-15-38(16-8-14-37)46-28-34(42)26-44-36-23-19-32(20-24-36)40-30-11-5-2-6-12-30/h1-6,9-12,17-24,33-34,37-42H,7-8,13-16,25-28H2