3-[[2-[[2-(3-heptanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl heptanoate

Systemtic Name: 3-[[2-[[2-(3-heptanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl heptanoate Openeye Name: 3-[[2-[[2-(3-heptanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl heptanoate CAS Name: heptanoic acid 3-[[oxo-[2-[[2-[oxo-[3-(1-oxoheptoxy)propylamino]methyl]phenyl]disulfanyl]phenyl]methyl]amino]propyl ester IUPAC Name: 3-[[2-[[2-(3-heptanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl heptanoate Traditional Name: enanthic acid 3-[[2-[[2-(3-enanthyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl ester Formula: C34H48N2O6S2 MolecularWeight: 644.88472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H48N2O6S2/c1-3-5-7-9-21-31(37)41-25-15-23-35-33(39)27-17-11-13-19-29(27)43-44-30-20-14-12-18-28(30)34(40)36-24-16-26-42-32(38)22-10-8-6-4-2/h11-14,17-20H,3-10,15-16,21-26H2,1-2H3,(H,35,39)(H,36,40)