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tert-butyl N-[2-[3-(2,3-dioctadecoxypropylsulfanyl)propanoylamino]ethyl]carbamate

tert-butyl N-[2-[3-(2,3-dioctadecoxypropylsulfanyl)propanoylamino]ethyl]carbamate

Systemtic Name:tert-butyl N-[2-[3-(2,3-dioctadecoxypropylsulfanyl)propanoylamino]ethyl]carbamate
Openeye Name:tert-butyl N-[2-[3-(2,3-dioctadecoxypropylsulfanyl)propanoylamino]ethyl]carbamate
CAS Name:N-[2-[[3-(2,3-dioctadecoxypropylthio)-1-oxopropyl]amino]ethyl]carbamic acid tert-butyl ester
IUPAC Name:tert-butyl N-[2-[3-(2,3-dioctadecoxypropylsulfanyl)propanoylamino]ethyl]carbamate
Traditional Name:N-[2-[3-(2,3-distearyloxypropylthio)propanoylamino]ethyl]carbamic acid tert-butyl ester
Formula: C49H98N2O5S
MolecularWeight: 827.37782
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CSCCC(=O)NCCNC(=O)OC(C)(C)C)OCCCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CSCCC(=O)NCCNC(=O)OC(C)(C)C)OCCCCCCCCCCCCCCCCCC


InChI

InChI=1S/C49H98N2O5S/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41-54-44-46(45-57-43-38-47(52)50-39-40-51-48(53)56-49(3,4)5)55-42-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h46H,6-45H2,1-5H3,(H,50,52)(H,51,53)


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