3-(pyridin-2-yldisulfanyl)propanoyl (4E)-4-hydroxyimino-4-[3-(pyridin-2-yldisulfanyl)propanoyloxy]butanoate

Systemtic Name: 3-(pyridin-2-yldisulfanyl)propanoyl (4E)-4-hydroxyimino-4-[3-(pyridin-2-yldisulfanyl)propanoyloxy]butanoate Openeye Name: 3-(2-pyridyldisulfanyl)propanoyl (4E)-4-hydroxyimino-4-[3-(2-pyridyldisulfanyl)propanoyloxy]butanoate CAS Name: (4E)-4-hydroxyimino-4-[1-oxo-3-(2-pyridinyldisulfanyl)propoxy]butanoic acid [1-oxo-3-(2-pyridinyldisulfanyl)propyl] ester IUPAC Name: 3-(pyridin-2-yldisulfanyl)propanoyl (4E)-4-hydroxyimino-4-[3-(pyridin-2-yldisulfanyl)propanoyloxy]butanoate Traditional Name: (4E)-4-hydroximino-4-[3-(2-pyridyldisulfanyl)propanoyloxy]butyric acid 3-(2-pyridyldisulfanyl)propanoyl ester Formula: C20H21N3O6S4 MolecularWeight: 527.65724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SSCCC(=O)OC(=NO)CCC(=O)OC(=O)CCSSC2=CC=CC=N2

Isomeric SMILES

C1=CC=NC(=C1)SSCCC(=O)O/C(=N/O)/CCC(=O)OC(=O)CCSSC2=CC=CC=N2

InChI

InChI=1S/C20H21N3O6S4/c24-18(29-20(26)10-14-31-33-17-6-2-4-12-22-17)8-7-15(23-27)28-19(25)9-13-30-32-16-5-1-3-11-21-16/h1-6,11-12,27H,7-10,13-14H2/b23-15+