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

Systemtic Name: 3-[[3-ethyl-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 3-[[3-ethyl-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylene]-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 3-[[3-ethyl-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 3-[[3-ethyl-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 3-[[3-ethyl-4-keto-5-(3-methoxy-4-propargyloxy-benzylidene)thiazolidin-2-ylidene]amino]benzoic acid Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O5S/c1-4-11-30-18-10-9-15(12-19(18)29-3)13-20-21(26)25(5-2)23(31-20)24-17-8-6-7-16(14-17)22(27)28/h1,6-10,12-14H,5,11H2,2-3H3,(H,27,28)