4-[(5Z)-5-[(4-ethyl-3-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[(5Z)-5-[(4-ethyl-3-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[(5Z)-5-[(4-ethyl-3-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[(5Z)-5-[(4-ethyl-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[(5Z)-5-[(4-ethyl-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[(5Z)-5-(4-ethyl-3-nitro-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S2/c1-2-11-6-5-10(8-12(11)18(22)23)9-13-15(21)17(16(24)25-13)7-3-4-14(19)20/h5-6,8-9H,2-4,7H2,1H3,(H,19,20)/b13-9-