sodium 3-[(5E)-5-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-methyl-2-sulfanylidene-1,3,4-thiadiazolidin-3-yl]benzenesulfonate

Systemtic Name: sodium 3-[(5E)-5-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-methyl-2-sulfanylidene-1,3,4-thiadiazolidin-3-yl]benzenesulfonate Openeye Name: sodium 3-[(5E)-5-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-4-methyl-2-thioxo-1,3,4-thiadiazolidin-3-yl]benzenesulfonate CAS Name: sodium 3-[(5E)-5-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-4-methyl-2-sulfanylidene-1,3,4-thiadiazolidin-3-yl]benzenesulfonate IUPAC Name: sodium 3-[(5E)-5-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-methyl-2-sulfanylidene-1,3,4-thiadiazolidin-3-yl]benzenesulfonate Traditional Name: sodium 3-[(5E)-5-(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)-4-methyl-2-thioxo-1,3,4-thiadiazolidin-3-yl]besylate Formula: C14H12N3NaO4S5 MolecularWeight: 469.57755

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C2N(N(C(=S)S2)C3=CC(=CC=C3)S(=O)(=O)[O-])C)SC1=S.[Na+]

Isomeric SMILES

CCN1C(=O)/C(=C\2/N(N(C(=S)S2)C3=CC(=CC=C3)S(=O)(=O)[O-])C)/SC1=S.[Na+]

InChI

InChI=1S/C14H13N3O4S5.Na/c1-3-16-11(18)10(24-13(16)22)12-15(2)17(14(23)25-12)8-5-4-6-9(7-8)26(19,20)21;/h4-7H,3H2,1-2H3,(H,19,20,21);/q;+1/p-1/b12-10+;