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

Systemtic Name: 6-[(5E)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: 6-[(5E)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoate CAS Name: 6-[(5E)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoate IUPAC Name: 6-[(5E)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 6-[(5E)-4-keto-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-2-thioxo-thiazolidin-3-yl]hexanoate Formula: C18H17N2O5S2- MolecularWeight: 405.46798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5S2/c21-16(22)7-2-1-3-12-19-17(23)15(27-18(19)26)6-4-5-13-8-10-14(11-9-13)20(24)25/h4-6,8-11H,1-3,7,12H2,(H,21,22)/p-1/b5-4+,15-6+