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

Systemtic Name: 2-[4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-[4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-[2-(3,4-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(=C(C=C3)C)C)C(=O)O

Isomeric SMILES

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

InChI

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