2-(3-chloranyl-4-fluoranyl-phenyl)-5-ethyl-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)-5-ethyl-1,3-thiazole-4-carboxylic acid Openeye Name: 2-(3-chloro-4-fluoro-phenyl)-5-ethyl-thiazole-4-carboxylic acid CAS Name: 2-(3-chloro-4-fluorophenyl)-5-ethyl-4-thiazolecarboxylic acid IUPAC Name: 2-(3-chloro-4-fluorophenyl)-5-ethyl-1,3-thiazole-4-carboxylic acid Traditional Name: 2-(3-chloro-4-fluoro-phenyl)-5-ethyl-thiazole-4-carboxylic acid Formula: C12H9ClFNO2S MolecularWeight: 285.721763

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)C2=CC(=C(C=C2)F)Cl)C(=O)O

Isomeric SMILES

CCC1=C(N=C(S1)C2=CC(=C(C=C2)F)Cl)C(=O)O

InChI

InChI=1S/C12H9ClFNO2S/c1-2-9-10(12(16)17)15-11(18-9)6-3-4-8(14)7(13)5-6/h3-5H,2H2,1H3,(H,16,17)