4-[[5-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[5-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 4-[[5-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylene]-3-ethyl-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 4-[[5-[(3-ethoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 4-[[5-[(3-ethoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 4-[[5-(3-ethoxy-4-propargyloxy-benzylidene)-3-ethyl-4-keto-thiazolidin-2-ylidene]amino]benzoic acid Formula: C24H22N2O5S MolecularWeight: 450.50688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C=C2)OCC#C)OCC)SC1=NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCN1C(=O)C(=CC2=CC(=C(C=C2)OCC#C)OCC)SC1=NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H22N2O5S/c1-4-13-31-19-12-7-16(14-20(19)30-6-3)15-21-22(27)26(5-2)24(32-21)25-18-10-8-17(9-11-18)23(28)29/h1,7-12,14-15H,5-6,13H2,2-3H3,(H,28,29)