(5E)-3-butyl-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-3-butyl-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-3-butyl-5-[(4-hydroxy-3-nitro-phenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5E)-3-butyl-5-[(4-hydroxy-3-nitrophenyl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-3-butyl-5-[(4-hydroxy-3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-3-butyl-5-(4-hydroxy-3-nitro-benzylidene)-2-thioxo-thiazolidin-4-one Formula: C14H14N2O4S2 MolecularWeight: 338.40196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])SC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C\C2=CC(=C(C=C2)O)[N+](=O)[O-])/SC1=S

InChI

InChI=1S/C14H14N2O4S2/c1-2-3-6-15-13(18)12(22-14(15)21)8-9-4-5-11(17)10(7-9)16(19)20/h4-5,7-8,17H,2-3,6H2,1H3/b12-8+