disodium N-[3-methyl-6,8-bis(oxidanidylperoxysulfanyl)naphthalen-1-yl]ethanethioamide

Systemtic Name: disodium N-[3-methyl-6,8-bis(oxidanidylperoxysulfanyl)naphthalen-1-yl]ethanethioamide Openeye Name: disodium N-[3-methyl-6,8-bis(oxidoperoxysulfanyl)-1-naphthyl]thioacetamide CAS Name: disodium 6-methyl-8-(1-sulfanylideneethylamino)naphthalene-1,3-disulfenic acid dioxidooxy ester IUPAC Name: disodium N-[3-methyl-6,8-bis(oxidoperoxysulfanyl)naphthalen-1-yl]ethanethioamide Traditional Name: disodium N-[3-methyl-6,8-bis(oxidoperoxythio)-1-naphthyl]thioacetamide Formula: C13H11NNa2O6S3 MolecularWeight: 419.40408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C=C2SOO[O-])SOO[O-])NC(=S)C.[Na+].[Na+]

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C=C2SOO[O-])SOO[O-])NC(=S)C.[Na+].[Na+]

InChI

InChI=1S/C13H13NO6S3.2Na/c1-7-3-9-5-10(22-19-17-15)6-12(23-20-18-16)13(9)11(4-7)14-8(2)21;;/h3-6,15-16H,1-2H3,(H,14,21);;/q;2*+1/p-2