S-dodecyl N-[(E)-2-(dodecylsulfanylcarbonylamino)ethenyl]carbamothioate

Systemtic Name: S-dodecyl N-[(E)-2-(dodecylsulfanylcarbonylamino)ethenyl]carbamothioate Openeye Name: S-dodecyl N-[(E)-2-(dodecylsulfanylcarbonylamino)vinyl]carbamothioate CAS Name: N-[(E)-2-[[(dodecylthio)-oxomethyl]amino]ethenyl]carbamothioic acid S-dodecyl ester IUPAC Name: S-dodecyl N-[(E)-2-(dodecylsulfanylcarbonylamino)ethenyl]carbamothioate Traditional Name: N-[(E)-2-[(laurylthio)carbonylamino]vinyl]thiocarbamic acid S-lauryl ester Formula: C28H54N2O2S2 MolecularWeight: 514.87056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=O)NC=CNC(=O)SCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCSC(=O)N/C=C/NC(=O)SCCCCCCCCCCCC

InChI

InChI=1S/C28H54N2O2S2/c1-3-5-7-9-11-13-15-17-19-21-25-33-27(31)29-23-24-30-28(32)34-26-22-20-18-16-14-12-10-8-6-4-2/h23-24H,3-22,25-26H2,1-2H3,(H,29,31)(H,30,32)/b24-23+