4-[(5E)-5-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: 4-[(5E)-5-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 4-[(5E)-5-[(5-bromo-2-hydroxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5E)-5-[(5-bromo-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: 4-[(5E)-5-[(5-bromo-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5E)-5-(5-bromo-2-hydroxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyrate Formula: C14H11BrNO4S2- MolecularWeight: 401.27544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C=C2C(=O)N(C(=S)S2)CCCC(=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1Br)/C=C/2\C(=O)N(C(=S)S2)CCCC(=O)[O-])O

InChI

InChI=1S/C14H12BrNO4S2/c15-9-3-4-10(17)8(6-9)7-11-13(20)16(14(21)22-11)5-1-2-12(18)19/h3-4,6-7,17H,1-2,5H2,(H,18,19)/p-1/b11-7+