3-[(5Z)-5-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: 3-[(5Z)-5-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: 3-[(5Z)-5-[(3-bromo-4,5-dimethoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5Z)-5-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoate IUPAC Name: 3-[(5Z)-5-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5Z)-5-(3-bromo-4,5-dimethoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionate Formula: C15H13BrNO5S2- MolecularWeight: 431.30142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)[O-])Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CCC(=O)[O-])Br)OC

InChI

InChI=1S/C15H14BrNO5S2/c1-21-10-6-8(5-9(16)13(10)22-2)7-11-14(20)17(15(23)24-11)4-3-12(18)19/h5-7H,3-4H2,1-2H3,(H,18,19)/p-1/b11-7-