S-[3-[[2-(dimethylcarbamoylsulfanyl)-5-nitro-pyridin-3-yl]disulfanyl]-5-nitro-pyridin-2-yl] N,N-dimethylcarbamothioate

Systemtic Name: S-[3-[[2-(dimethylcarbamoylsulfanyl)-5-nitro-pyridin-3-yl]disulfanyl]-5-nitro-pyridin-2-yl] N,N-dimethylcarbamothioate Openeye Name: S-[[3-[[2-(dimethylcarbamoylsulfanyl)-5-nitro-3-pyridyl]disulfanyl]-5-nitro-2-pyridyl]] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[[3-[[2-[[dimethylamino(oxo)methyl]thio]-5-nitro-3-pyridinyl]disulfanyl]-5-nitro-2-pyridinyl]] ester IUPAC Name: S-[3-[[2-(dimethylcarbamoylsulfanyl)-5-nitropyridin-3-yl]disulfanyl]-5-nitropyridin-2-yl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[[3-[[2-(dimethylcarbamoylthio)-5-nitro-3-pyridyl]disulfanyl]-5-nitro-2-pyridyl]] ester Formula: C16H16N6O6S4 MolecularWeight: 516.59484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=C(C=C(C=N1)[N+](=O)[O-])SSC2=C(N=CC(=C2)[N+](=O)[O-])SC(=O)N(C)C

Isomeric SMILES

CN(C)C(=O)SC1=C(C=C(C=N1)[N+](=O)[O-])SSC2=C(N=CC(=C2)[N+](=O)[O-])SC(=O)N(C)C

InChI

InChI=1S/C16H16N6O6S4/c1-19(2)15(23)29-13-11(5-9(7-17-13)21(25)26)31-32-12-6-10(22(27)28)8-18-14(12)30-16(24)20(3)4/h5-8H,1-4H3