2-[4-[2-(3,5-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[4-[2-(3,5-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-[2-(3,5-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-[4-[2-(3,5-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-[2-(3,5-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-[2-(3,5-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-thiazole-5-carboxylic acid Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC=C(C=C2)OCCOC3=CC(=CC(=C3)C)C)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC=C(C=C2)OCCOC3=CC(=CC(=C3)C)C)C(=O)O

InChI

InChI=1S/C22H23NO4S/c1-4-19-20(22(24)25)28-21(23-19)16-5-7-17(8-6-16)26-9-10-27-18-12-14(2)11-15(3)13-18/h5-8,11-13H,4,9-10H2,1-3H3,(H,24,25)