5-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate

Systemtic Name: 5-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Openeye Name: 5-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]benzene-1,3-dicarboxylate CAS Name: 5-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]isophthalate Formula: C19H9N3O5S2-2 MolecularWeight: 423.42186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C=C3C(=O)N(C(=S)S3)C4=CC(=CC(=C4)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)/C=C/3\C(=O)N(C(=S)S3)C4=CC(=CC(=C4)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C19H11N3O5S2/c23-16-14(8-15-20-12-3-1-2-4-13(12)21-15)29-19(28)22(16)11-6-9(17(24)25)5-10(7-11)18(26)27/h1-8H,(H,20,21)(H,24,25)(H,26,27)/p-2/b14-8+