3-[[5-[(4-ethoxy-3-methoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 3-[[5-[(4-ethoxy-3-methoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 3-[[5-[(4-ethoxy-3-methoxy-phenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 3-[[5-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoic acid IUPAC Name: 3-[[5-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 3-[[5-(4-ethoxy-3-methoxy-benzylidene)-4-keto-2-thiazolin-2-yl]amino]benzoic acid Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)O)OC

InChI

InChI=1S/C20H18N2O5S/c1-3-27-15-8-7-12(9-16(15)26-2)10-17-18(23)22-20(28-17)21-14-6-4-5-13(11-14)19(24)25/h4-11H,3H2,1-2H3,(H,24,25)(H,21,22,23)