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

Systemtic Name: 4-methyl-2-[2-[4-(2-methylbutan-2-yl)phenoxy]ethyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-[4-(1,1-dimethylpropyl)phenoxy]ethyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 4-methyl-2-[2-[4-(2-methylbutan-2-yl)phenoxy]ethyl]-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-[2-[4-(2-methylbutan-2-yl)phenoxy]ethyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-(4-tert-amylphenoxy)ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCC2=NC(=C(S2)C(=O)O)C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCC2=NC(=C(S2)C(=O)O)C

InChI

InChI=1S/C18H23NO3S/c1-5-18(3,4)13-6-8-14(9-7-13)22-11-10-15-19-12(2)16(23-15)17(20)21/h6-9H,5,10-11H2,1-4H3,(H,20,21)