2-[(5Z)-5-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate

Systemtic Name: 2-[(5Z)-5-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Openeye Name: 2-[(5Z)-5-[(3-ethoxy-4-hydroxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonate CAS Name: 2-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonate IUPAC Name: 2-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Traditional Name: 2-[(5Z)-5-(3-ethoxy-4-hydroxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]ethanesulfonate Formula: C14H14NO6S3- MolecularWeight: 388.45906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCS(=O)(=O)[O-])O

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CCS(=O)(=O)[O-])O

InChI

InChI=1S/C14H15NO6S3/c1-2-21-11-7-9(3-4-10(11)16)8-12-13(17)15(14(22)23-12)5-6-24(18,19)20/h3-4,7-8,16H,2,5-6H2,1H3,(H,18,19,20)/p-1/b12-8-