4-[[4-oxidanylidene-5-[(2-propan-2-yloxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[4-oxidanylidene-5-[(2-propan-2-yloxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[5-[(2-isopropoxyphenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[4-oxo-5-[(2-propan-2-yloxyphenyl)methylidene]-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[4-oxo-5-[(2-propan-2-yloxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[5-(2-isopropoxybenzylidene)-4-keto-2-thiazolin-2-yl]amino]benzoic acid Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)OC1=CC=CC=C1C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H18N2O4S/c1-12(2)26-16-6-4-3-5-14(16)11-17-18(23)22-20(27-17)21-15-9-7-13(8-10-15)19(24)25/h3-12H,1-2H3,(H,24,25)(H,21,22,23)