4-[(5Z)-5-[(4,5-dimethoxy-2-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: 4-[(5Z)-5-[(4,5-dimethoxy-2-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 4-[(5Z)-5-[(4,5-dimethoxy-2-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-5-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: 4-[(5Z)-5-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-5-(4,5-dimethoxy-2-nitro-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyrate Formula: C16H15N2O7S2- MolecularWeight: 411.4295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)[O-])[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)[O-])[N+](=O)[O-])OC

InChI

InChI=1S/C16H16N2O7S2/c1-24-11-6-9(10(18(22)23)8-12(11)25-2)7-13-15(21)17(16(26)27-13)5-3-4-14(19)20/h6-8H,3-5H2,1-2H3,(H,19,20)/p-1/b13-7-