4-methyl-2-[4-[[4-(2-methylbutan-2-yl)phenoxy]methyl]phenyl]-1,3-thiazole-5-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C

InChI

InChI=1S/C23H25NO3S/c1-5-23(3,4)18-10-12-19(13-11-18)27-14-16-6-8-17(9-7-16)21-24-15(2)20(28-21)22(25)26/h6-13H,5,14H2,1-4H3,(H,25,26)