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

Systemtic Name: (2S)-2-[(5E)-5-[(4-methanoylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: (2S)-2-[(5E)-5-[(4-formylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: (2S)-2-[(5E)-5-[(4-formylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: (2S)-2-[(5E)-5-[(4-formylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: (2S)-2-[(5E)-5-(4-formylbenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyrate Formula: C15H12NO4S2- MolecularWeight: 334.39008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C(=O)C(=CC2=CC=C(C=C2)C=O)SC1=S

Isomeric SMILES

CC[C@@H](C(=O)[O-])N1C(=O)/C(=C\C2=CC=C(C=C2)C=O)/SC1=S

InChI

InChI=1S/C15H13NO4S2/c1-2-11(14(19)20)16-13(18)12(22-15(16)21)7-9-3-5-10(8-17)6-4-9/h3-8,11H,2H2,1H3,(H,19,20)/p-1/b12-7+/t11-/m0/s1