3-[[2-[[2-(3-butanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl butanoate

Systemtic Name: 3-[[2-[[2-(3-butanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl butanoate Openeye Name: 3-[[2-[[2-(3-butanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl butanoate CAS Name: butanoic acid 3-[[oxo-[2-[[2-[oxo-[3-(1-oxobutoxy)propylamino]methyl]phenyl]disulfanyl]phenyl]methyl]amino]propyl ester IUPAC Name: 3-[[2-[[2-(3-butanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl butanoate Traditional Name: butyric acid 3-[[2-[[2-(3-butyryloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl ester Formula: C28H36N2O6S2 MolecularWeight: 560.72524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCCNC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NCCCOC(=O)CCC

Isomeric SMILES

CCCC(=O)OCCCNC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NCCCOC(=O)CCC

InChI

InChI=1S/C28H36N2O6S2/c1-3-11-25(31)35-19-9-17-29-27(33)21-13-5-7-15-23(21)37-38-24-16-8-6-14-22(24)28(34)30-18-10-20-36-26(32)12-4-2/h5-8,13-16H,3-4,9-12,17-20H2,1-2H3,(H,29,33)(H,30,34)