4-ethyl-2-(3-methoxy-4-phenethyloxy-phenyl)-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-ethyl-2-(3-methoxy-4-phenethyloxy-phenyl)-1,3-thiazole-5-carboxylic acid Openeye Name: 4-ethyl-2-(3-methoxy-4-phenethyloxy-phenyl)thiazole-5-carboxylic acid CAS Name: 4-ethyl-2-(3-methoxy-4-phenethyloxyphenyl)-5-thiazolecarboxylic acid IUPAC Name: 4-ethyl-2-(3-methoxy-4-phenethyloxyphenyl)-1,3-thiazole-5-carboxylic acid Traditional Name: 4-ethyl-2-(3-methoxy-4-phenethyloxy-phenyl)thiazole-5-carboxylic acid Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)OC)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)OC)C(=O)O

InChI

InChI=1S/C21H21NO4S/c1-3-16-19(21(23)24)27-20(22-16)15-9-10-17(18(13-15)25-2)26-12-11-14-7-5-4-6-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,23,24)