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

Systemtic Name: 4-[[(5Z)-4-oxidanylidene-5-[(4-propan-2-ylphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[(5Z)-5-[(4-isopropylphenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[(5Z)-4-oxo-5-[(4-propan-2-ylphenyl)methylidene]-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[(5Z)-4-oxo-5-[(4-propan-2-ylphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[(5Z)-5-(4-isopropylbenzylidene)-4-keto-2-thiazolin-2-yl]amino]benzoic acid Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C\2/C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H18N2O3S/c1-12(2)14-5-3-13(4-6-14)11-17-18(23)22-20(26-17)21-16-9-7-15(8-10-16)19(24)25/h3-12H,1-2H3,(H,24,25)(H,21,22,23)/b17-11-