(5Z)-3-(2-ethylhexyl)-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-3-(2-ethylhexyl)-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-3-(2-ethylhexyl)-5-[(5-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-3-(2-ethylhexyl)-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-3-(2-ethylhexyl)-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-3-(2-ethylhexyl)-5-[(5-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-thiazolidin-4-one Formula: C21H25N3OS2 MolecularWeight: 399.5727

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1C(=O)C(=CC2=C(NN=C2)C3=CC=CC=C3)SC1=S

Isomeric SMILES

CCCCC(CC)CN1C(=O)/C(=C/C2=C(NN=C2)C3=CC=CC=C3)/SC1=S

InChI

InChI=1S/C21H25N3OS2/c1-3-5-9-15(4-2)14-24-20(25)18(27-21(24)26)12-17-13-22-23-19(17)16-10-7-6-8-11-16/h6-8,10-13,15H,3-5,9,14H2,1-2H3,(H,22,23)/b18-12-