2-[4-(4-chloranyl-3,5-dimethyl-phenoxy)phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[4-(4-chloranyl-3,5-dimethyl-phenoxy)phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-(4-chloro-3,5-dimethyl-phenoxy)phenyl]-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-[4-(4-chloro-3,5-dimethylphenoxy)phenyl]-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-(4-chloro-3,5-dimethylphenoxy)phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-(4-chloro-3,5-dimethyl-phenoxy)phenyl]-4-ethyl-thiazole-5-carboxylic acid Formula: C20H18ClNO3S MolecularWeight: 387.87982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC=C(C=C2)OC3=CC(=C(C(=C3)C)Cl)C)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC=C(C=C2)OC3=CC(=C(C(=C3)C)Cl)C)C(=O)O

InChI

InChI=1S/C20H18ClNO3S/c1-4-16-18(20(23)24)26-19(22-16)13-5-7-14(8-6-13)25-15-9-11(2)17(21)12(3)10-15/h5-10H,4H2,1-3H3,(H,23,24)