6-[(5E)-4-oxidanylidene-5-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: 6-[(5E)-4-oxidanylidene-5-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: 6-[(5E)-4-oxo-5-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-3-yl]hexanoate CAS Name: 6-[(5E)-4-oxo-5-[[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylidene]-2-sulfanylidene-3-thiazolidinyl]hexanoate IUPAC Name: 6-[(5E)-4-oxo-5-[(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 6-[(5E)-4-keto-5-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-3-yl]hexanoate Formula: C24H21N4O3S2- MolecularWeight: 477.57854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=C4C(=O)N(C(=S)S4)CCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)/C=C/4\C(=O)N(C(=S)S4)CCCCCC(=O)[O-]

InChI

InChI=1S/C24H22N4O3S2/c29-21(30)11-5-2-6-13-27-23(31)20(33-24(27)32)14-18-16-28(19-9-3-1-4-10-19)26-22(18)17-8-7-12-25-15-17/h1,3-4,7-10,12,14-16H,2,5-6,11,13H2,(H,29,30)/p-1/b20-14+