ethyl 4-[3-[4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoate

Systemtic Name: ethyl 4-[3-[4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoate Openeye Name: ethyl 4-[3-(5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl)propanoylamino]benzoate CAS Name: 4-[[1-oxo-3-[4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoylamino]benzoate Traditional Name: 4-[3-(5-benzal-4-keto-2-thioxo-thiazolidin-3-yl)propanoylamino]benzoic acid ethyl ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

InChI

InChI=1S/C22H20N2O4S2/c1-2-28-21(27)16-8-10-17(11-9-16)23-19(25)12-13-24-20(26)18(30-22(24)29)14-15-6-4-3-5-7-15/h3-11,14H,2,12-13H2,1H3,(H,23,25)