4-ethyl-2-[4-(2,3,6-trimethylphenoxy)phenyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-ethyl-2-[4-(2,3,6-trimethylphenoxy)phenyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-ethyl-2-[4-(2,3,6-trimethylphenoxy)phenyl]thiazole-5-carboxylic acid CAS Name: 4-ethyl-2-[4-(2,3,6-trimethylphenoxy)phenyl]-5-thiazolecarboxylic acid IUPAC Name: 4-ethyl-2-[4-(2,3,6-trimethylphenoxy)phenyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 4-ethyl-2-[4-(2,3,6-trimethylphenoxy)phenyl]thiazole-5-carboxylic acid Formula: C21H21NO3S MolecularWeight: 367.46134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC=C(C=C2)OC3=C(C=CC(=C3C)C)C)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC=C(C=C2)OC3=C(C=CC(=C3C)C)C)C(=O)O

InChI

InChI=1S/C21H21NO3S/c1-5-17-19(21(23)24)26-20(22-17)15-8-10-16(11-9-15)25-18-13(3)7-6-12(2)14(18)4/h6-11H,5H2,1-4H3,(H,23,24)