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

Systemtic Name: 5-[(5E)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Openeye Name: 5-[(5E)-5-[(1-methylpyrrol-2-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzene-1,3-dicarboxylate CAS Name: 5-[(5E)-5-[(1-methyl-2-pyrrolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[(5E)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[(5E)-4-keto-5-[(1-methylpyrrol-2-yl)methylene]-2-thioxo-thiazolidin-3-yl]isophthalate Formula: C17H10N2O5S2-2 MolecularWeight: 386.4017

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=C2C(=O)N(C(=S)S2)C3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CN1C=CC=C1/C=C/2\C(=O)N(C(=S)S2)C3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H12N2O5S2/c1-18-4-2-3-11(18)8-13-14(20)19(17(25)26-13)12-6-9(15(21)22)5-10(7-12)16(23)24/h2-8H,1H3,(H,21,22)(H,23,24)/p-2/b13-8+