4-[[3-(1-oxidanidyl-1-oxidanylidene-3-phenyl-propan-2-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate

Systemtic Name: 4-[[3-(1-oxidanidyl-1-oxidanylidene-3-phenyl-propan-2-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: 4-[[3-(1-benzyl-2-oxido-2-oxo-ethyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]benzoate CAS Name: 4-[[3-(1-oxido-1-oxo-3-phenylpropan-2-yl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoate IUPAC Name: 4-[[3-(1-oxido-1-oxo-3-phenylpropan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[[3-(1-benzyl-2-keto-2-oxido-ethyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]benzoate Formula: C20H13NO5S2-2 MolecularWeight: 411.45092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])N2C(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])SC2=S

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)[O-])N2C(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])SC2=S

InChI

InChI=1S/C20H15NO5S2/c22-17-16(11-13-6-8-14(9-7-13)18(23)24)28-20(27)21(17)15(19(25)26)10-12-4-2-1-3-5-12/h1-9,11,15H,10H2,(H,23,24)(H,25,26)/p-2