1-[[5-(2-oxidanylhexadecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]hexadecan-2-ol

Systemtic Name: 1-[[5-(2-oxidanylhexadecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]hexadecan-2-ol Openeye Name: 1-[[5-(2-hydroxyhexadecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]hexadecan-2-ol CAS Name: 1-[[5-(2-hydroxyhexadecylthio)-1,3,4-thiadiazol-2-yl]thio]-2-hexadecanol IUPAC Name: 1-[[5-(2-hydroxyhexadecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]hexadecan-2-ol Traditional Name: 1-[[5-(2-hydroxyhexadecylthio)-1,3,4-thiadiazol-2-yl]thio]hexadecan-2-ol Formula: C34H66N2O2S3 MolecularWeight: 631.09504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CSC1=NN=C(S1)SCC(CCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCC(CSC1=NN=C(S1)SCC(CCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C34H66N2O2S3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31(37)29-39-33-35-36-34(41-33)40-30-32(38)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32,37-38H,3-30H2,1-2H3