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

Systemtic Name: 5-[(5E)-4-oxidanylidene-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Openeye Name: 5-[(5E)-4-oxo-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-thiazolidin-3-yl]benzene-1,3-dicarboxylate CAS Name: 5-[(5E)-4-oxo-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-3-thiazolidinyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[(5E)-4-oxo-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[(5E)-4-keto-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-thiazolidin-3-yl]isophthalate Formula: C16H8N2O5S2-2 MolecularWeight: 372.37512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10N2O5S2/c19-13-12(7-10-2-1-3-17-10)25-16(24)18(13)11-5-8(14(20)21)4-9(6-11)15(22)23/h1-7,17H,(H,20,21)(H,22,23)/p-2/b12-7+