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

Systemtic Name: 2-[4-[(2-tert-butyl-4-ethyl-phenoxy)methyl]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-[(2-tert-butyl-4-ethyl-phenoxy)methyl]phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[4-[(2-tert-butyl-4-ethylphenoxy)methyl]phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-[(2-tert-butyl-4-ethylphenoxy)methyl]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-[(2-tert-butyl-4-ethyl-phenoxy)methyl]phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C24H27NO3S MolecularWeight: 409.54108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C)C(C)(C)C

InChI

InChI=1S/C24H27NO3S/c1-6-16-9-12-20(19(13-16)24(3,4)5)28-14-17-7-10-18(11-8-17)22-25-15(2)21(29-22)23(26)27/h7-13H,6,14H2,1-5H3,(H,26,27)