disodium 2-sulfanylidene-3H-1,3-benzothiazole-4,6-disulfonate

Systemtic Name: disodium 2-sulfanylidene-3H-1,3-benzothiazole-4,6-disulfonate Openeye Name: disodium 2-thioxo-3H-1,3-benzothiazole-4,6-disulfonate CAS Name: disodium 2-sulfanylidene-3H-1,3-benzothiazole-4,6-disulfonate IUPAC Name: disodium 2-sulfanylidene-3H-1,3-benzothiazole-4,6-disulfonate Traditional Name: disodium 2-thioxo-3H-1,3-benzothiazole-4,6-disulfonate Formula: C7H3NNa2O6S4 MolecularWeight: 371.34136

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1S(=O)(=O)[O-])NC(=S)S2)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=C(C=C2C(=C1S(=O)(=O)[O-])NC(=S)S2)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C7H5NO6S4.2Na/c9-17(10,11)3-1-4-6(8-7(15)16-4)5(2-3)18(12,13)14;;/h1-2H,(H,8,15)(H,9,10,11)(H,12,13,14);;/q;2*+1/p-2