3-[[2-[[2-(3-hexanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl hexanoate

Systemtic Name: 3-[[2-[[2-(3-hexanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl hexanoate Openeye Name: 3-[[2-[[2-(3-hexanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl hexanoate CAS Name: hexanoic acid 3-[[oxo-[2-[[2-[oxo-[3-(1-oxohexoxy)propylamino]methyl]phenyl]disulfanyl]phenyl]methyl]amino]propyl ester IUPAC Name: 3-[[2-[[2-(3-hexanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl hexanoate Traditional Name: hexanoic acid 3-[[2-[[2-(3-caproyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl ester Formula: C32H44N2O6S2 MolecularWeight: 616.83156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCCCNC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NCCCOC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)OCCCNC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NCCCOC(=O)CCCCC

InChI

InChI=1S/C32H44N2O6S2/c1-3-5-7-19-29(35)39-23-13-21-33-31(37)25-15-9-11-17-27(25)41-42-28-18-12-10-16-26(28)32(38)34-22-14-24-40-30(36)20-8-6-4-2/h9-12,15-18H,3-8,13-14,19-24H2,1-2H3,(H,33,37)(H,34,38)