2-[4-(2-tert-butyl-4-ethyl-phenoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[4-(2-tert-butyl-4-ethyl-phenoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-(2-tert-butyl-4-ethyl-phenoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[4-(2-tert-butyl-4-ethylphenoxy)phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-(2-tert-butyl-4-ethylphenoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-(2-tert-butyl-4-ethyl-phenoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C23H25NO3S MolecularWeight: 395.5145

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C)C(C)(C)C

InChI

InChI=1S/C23H25NO3S/c1-6-15-7-12-19(18(13-15)23(3,4)5)27-17-10-8-16(9-11-17)21-24-14(2)20(28-21)22(25)26/h7-13H,6H2,1-5H3,(H,25,26)