S-(dicyclohexylamino) N,N-bis(icosylsulfanyl)carbamothioate

Systemtic Name: S-(dicyclohexylamino) N,N-bis(icosylsulfanyl)carbamothioate Openeye Name: S-(dicyclohexylamino) N,N-bis(icosylsulfanyl)carbamothioate CAS Name: N,N-bis(eicosylthio)carbamothioic acid S-(dicyclohexylamino) ester IUPAC Name: S-(dicyclohexylamino) N,N-bis(icosylsulfanyl)carbamothioate Traditional Name: N,N-bis(arachylthio)thiocarbamic acid S-(dicyclohexylamino) ester Formula: C53H104N2OS3 MolecularWeight: 881.60066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCSN(C(=O)SN(C1CCCCC1)C2CCCCC2)SCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCSN(C(=O)SN(C1CCCCC1)C2CCCCC2)SCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C53H104N2OS3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-43-49-57-55(53(56)59-54(51-45-39-37-40-46-51)52-47-41-38-42-48-52)58-50-44-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h51-52H,3-50H2,1-2H3