3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-[(3-ethoxy-4-propoxy-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-[(3-ethoxy-4-propoxy-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-5-[(3-ethoxy-4-propoxy-phenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-(3-ethoxy-4-propoxy-benzylidene)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-thioxo-thiazolidin-4-one Formula: C26H27N3O4S2 MolecularWeight: 509.64028

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)OCC

InChI

InChI=1S/C26H27N3O4S2/c1-5-14-33-20-13-12-18(15-21(20)32-6-2)16-22-24(30)28(26(34)35-22)23-17(3)27(4)29(25(23)31)19-10-8-7-9-11-19/h7-13,15-16H,5-6,14H2,1-4H3