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

Systemtic Name: 5-[(5E)-4-oxidanylidene-5-(pyridin-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Openeye Name: 5-[(5E)-4-oxo-5-(2-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]benzene-1,3-dicarboxylate CAS Name: 5-[(5E)-4-oxo-5-(2-pyridinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[(5E)-4-oxo-5-(pyridin-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[(5E)-4-keto-5-(2-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]isophthalate Formula: C17H8N2O5S2-2 MolecularWeight: 384.38582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)/C=C/2\C(=O)N(C(=S)S2)C3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H10N2O5S2/c20-14-13(8-11-3-1-2-4-18-11)26-17(25)19(14)12-6-9(15(21)22)5-10(7-12)16(23)24/h1-8H,(H,21,22)(H,23,24)/p-2/b13-8+