6-[5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: 6-[5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: 6-[5-[(2-nitrophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoate CAS Name: 6-[5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoate IUPAC Name: 6-[5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 6-[4-keto-5-(2-nitrobenzylidene)-2-thioxo-thiazolidin-3-yl]hexanoate Formula: C16H15N2O5S2- MolecularWeight: 379.4307

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S2/c19-14(20)8-2-1-5-9-17-15(21)13(25-16(17)24)10-11-6-3-4-7-12(11)18(22)23/h3-4,6-7,10H,1-2,5,8-9H2,(H,19,20)/p-1