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

Systemtic Name: 2-[(5E)-4-oxidanylidene-5-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: 2-[(5E)-4-oxo-5-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5E)-4-oxo-5-[[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylidene]-2-sulfanylidene-3-thiazolidinyl]acetate IUPAC Name: 2-[(5E)-4-oxo-5-[(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-4-keto-5-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-3-yl]acetate Formula: C20H13N4O3S2- MolecularWeight: 421.47222

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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)CC(=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)CC(=O)[O-]

InChI

InChI=1S/C20H14N4O3S2/c25-17(26)12-23-19(27)16(29-20(23)28)9-14-11-24(15-6-2-1-3-7-15)22-18(14)13-5-4-8-21-10-13/h1-11H,12H2,(H,25,26)/p-1/b16-9+