(2R)-2-[(5E)-5-[(4-methanoylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate

Systemtic Name: (2R)-2-[(5E)-5-[(4-methanoylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate Openeye Name: (2R)-2-[(5E)-5-[(4-formylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]pentanedioate CAS Name: (2R)-2-[(5E)-5-[(4-formylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]pentanedioate IUPAC Name: (2R)-2-[(5E)-5-[(4-formylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate Traditional Name: (2R)-2-[(5E)-5-(4-formylbenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]glutarate Formula: C16H11NO6S2-2 MolecularWeight: 377.39164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N(C(=S)S2)C(CCC(=O)[O-])C(=O)[O-])C=O

Isomeric SMILES

C1=CC(=CC=C1/C=C/2\C(=O)N(C(=S)S2)[C@H](CCC(=O)[O-])C(=O)[O-])C=O

InChI

InChI=1S/C16H13NO6S2/c18-8-10-3-1-9(2-4-10)7-12-14(21)17(16(24)25-12)11(15(22)23)5-6-13(19)20/h1-4,7-8,11H,5-6H2,(H,19,20)(H,22,23)/p-2/b12-7+/t11-/m1/s1