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

Systemtic Name: 4-methyl-2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-[4-(1,1-dimethylpropyl)phenoxy]phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 4-methyl-2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-(4-tert-amylphenoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO3S/c1-5-22(3,4)16-8-12-18(13-9-16)26-17-10-6-15(7-11-17)20-23-14(2)19(27-20)21(24)25/h6-13H,5H2,1-4H3,(H,24,25)