disodium (4Z)-7-oxidanidylperoxysulfanyl-3-oxidanylidene-4-(1,3,4-thiadiazol-2-ylhydrazinylidene)naphthalene-2-sulfonate

Systemtic Name: disodium (4Z)-7-oxidanidylperoxysulfanyl-3-oxidanylidene-4-(1,3,4-thiadiazol-2-ylhydrazinylidene)naphthalene-2-sulfonate Openeye Name: disodium (4Z)-7-oxidoperoxysulfanyl-3-oxo-4-(1,3,4-thiadiazol-2-ylhydrazono)naphthalene-2-sulfonate CAS Name: disodium (4Z)-7-(oxidodioxythio)-3-oxo-4-(1,3,4-thiadiazol-2-ylhydrazinylidene)-2-naphthalenesulfonate IUPAC Name: disodium (4Z)-7-oxidoperoxysulfanyl-3-oxo-4-(1,3,4-thiadiazol-2-ylhydrazinylidene)naphthalene-2-sulfonate Traditional Name: disodium (4Z)-3-keto-7-(oxidoperoxythio)-4-(1,3,4-thiadiazol-2-ylhydrazono)naphthalene-2-sulfonate Formula: C12H6N4Na2O7S3 MolecularWeight: 460.37318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1SOO[O-])C=C(C(=O)C2=NNC3=NN=CS3)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC\2=C(C=C1SOO[O-])C=C(C(=O)/C2=N\NC3=NN=CS3)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C12H8N4O7S3.2Na/c17-11-9(26(19,20)21)4-6-3-7(25-23-22-18)1-2-8(6)10(11)14-16-12-15-13-5-24-12;;/h1-5,18H,(H,15,16)(H,19,20,21);;/q;2*+1/p-2/b14-10-;;