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

Systemtic Name: 3-[[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 3-[[4-(4-isopropylphenyl)thiazol-2-yl]amino]benzoic acid CAS Name: 3-[[4-(4-propan-2-ylphenyl)-2-thiazolyl]amino]benzoic acid IUPAC Name: 3-[[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 3-[(4-p-cumenylthiazol-2-yl)amino]benzoic acid Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C19H18N2O2S/c1-12(2)13-6-8-14(9-7-13)17-11-24-19(21-17)20-16-5-3-4-15(10-16)18(22)23/h3-12H,1-2H3,(H,20,21)(H,22,23)