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

Systemtic Name: 2-[3-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[3-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]phenyl]thiazole-4-carboxylic acid CAS Name: 2-[3-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]phenyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[3-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[3-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]phenyl]thiazole-4-carboxylic acid Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCOC2=CC=CC(=C2)C3=NC(=CS3)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCOC2=CC=CC(=C2)C3=NC(=CS3)C(=O)O

InChI

InChI=1S/C22H23NO4S/c1-14(2)18-8-7-15(3)11-20(18)27-10-9-26-17-6-4-5-16(12-17)21-23-19(13-28-21)22(24)25/h4-8,11-14H,9-10H2,1-3H3,(H,24,25)