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

Systemtic Name: 2-[3-ethoxy-4-(3-phenylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[3-ethoxy-4-(3-phenylpropoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[3-ethoxy-4-(3-phenylpropoxy)phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[3-ethoxy-4-(3-phenylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[3-ethoxy-4-(3-phenylpropoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=NC(=C(S2)C(=O)O)C)OCCCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=NC(=C(S2)C(=O)O)C)OCCCC3=CC=CC=C3

InChI

InChI=1S/C22H23NO4S/c1-3-26-19-14-17(21-23-15(2)20(28-21)22(24)25)11-12-18(19)27-13-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-12,14H,3,7,10,13H2,1-2H3,(H,24,25)