ethyl 3-[[3-ethoxy-2-(hexanoylamino)-3-oxidanylidene-propyl]disulfanyl]-2-(hexanoylamino)propanoate

Systemtic Name: ethyl 3-[[3-ethoxy-2-(hexanoylamino)-3-oxidanylidene-propyl]disulfanyl]-2-(hexanoylamino)propanoate Openeye Name: ethyl 3-[[3-ethoxy-2-(hexanoylamino)-3-oxo-propyl]disulfanyl]-2-(hexanoylamino)propanoate CAS Name: 3-[[3-ethoxy-3-oxo-2-(1-oxohexylamino)propyl]disulfanyl]-2-(1-oxohexylamino)propanoic acid ethyl ester IUPAC Name: ethyl 3-[[3-ethoxy-2-(hexanoylamino)-3-oxopropyl]disulfanyl]-2-(hexanoylamino)propanoate Traditional Name: 2-(caproylamino)-3-[[2-(caproylamino)-3-ethoxy-3-keto-propyl]disulfanyl]propionic acid ethyl ester Formula: C22H40N2O6S2 MolecularWeight: 492.6928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(CSSCC(C(=O)OCC)NC(=O)CCCCC)C(=O)OCC

Isomeric SMILES

CCCCCC(=O)NC(CSSCC(C(=O)OCC)NC(=O)CCCCC)C(=O)OCC

InChI

InChI=1S/C22H40N2O6S2/c1-5-9-11-13-19(25)23-17(21(27)29-7-3)15-31-32-16-18(22(28)30-8-4)24-20(26)14-12-10-6-2/h17-18H,5-16H2,1-4H3,(H,23,25)(H,24,26)