5-[3-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]-2-oxidanyl-benzoate

Systemtic Name: 5-[3-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-5-[3-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]propanoylamino]benzoate CAS Name: 2-hydroxy-5-[[3-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-oxopropyl]amino]benzoate IUPAC Name: 2-hydroxy-5-[3-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoate Traditional Name: 2-hydroxy-5-[3-[(5E)-4-keto-5-(4-methylbenzylidene)-2-thioxo-thiazolidin-3-yl]propanoylamino]benzoate Formula: C21H17N2O5S2- MolecularWeight: 441.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC(=C(C=C3)O)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)CCC(=O)NC3=CC(=C(C=C3)O)C(=O)[O-]

InChI

InChI=1S/C21H18N2O5S2/c1-12-2-4-13(5-3-12)10-17-19(26)23(21(29)30-17)9-8-18(25)22-14-6-7-16(24)15(11-14)20(27)28/h2-7,10-11,24H,8-9H2,1H3,(H,22,25)(H,27,28)/p-1/b17-10+