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

Systemtic Name: 4-ethyl-2-[4-methoxy-2-(2-phenoxyethoxy)phenyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-ethyl-2-[4-methoxy-2-(2-phenoxyethoxy)phenyl]thiazole-5-carboxylic acid CAS Name: 4-ethyl-2-[4-methoxy-2-(2-phenoxyethoxy)phenyl]-5-thiazolecarboxylic acid IUPAC Name: 4-ethyl-2-[4-methoxy-2-(2-phenoxyethoxy)phenyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 4-ethyl-2-[4-methoxy-2-(2-phenoxyethoxy)phenyl]thiazole-5-carboxylic acid Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO5S/c1-3-17-19(21(23)24)28-20(22-17)16-10-9-15(25-2)13-18(16)27-12-11-26-14-7-5-4-6-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,23,24)