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

Systemtic Name: 4-ethyl-2-[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-ethyl-2-[3-methoxy-4-(o-tolylmethoxy)phenyl]thiazole-5-carboxylic acid CAS Name: 4-ethyl-2-[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]-5-thiazolecarboxylic acid IUPAC Name: 4-ethyl-2-[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 4-ethyl-2-[3-methoxy-4-(2-methylbenzyl)oxy-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)OCC3=CC=CC=C3C)OC)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC(=C(C=C2)OCC3=CC=CC=C3C)OC)C(=O)O

InChI

InChI=1S/C21H21NO4S/c1-4-16-19(21(23)24)27-20(22-16)14-9-10-17(18(11-14)25-3)26-12-15-8-6-5-7-13(15)2/h5-11H,4,12H2,1-3H3,(H,23,24)