2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(3-chloro-4-fluoro-anilino)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(3-chloro-4-fluoroanilino)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-chloro-4-fluoroanilino)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-chloro-4-fluoro-anilino)-4-methyl-thiazole-5-carboxylic acid Formula: C11H8ClFN2O2S MolecularWeight: 286.709823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=CC(=C(C=C2)F)Cl)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NC2=CC(=C(C=C2)F)Cl)C(=O)O

InChI

InChI=1S/C11H8ClFN2O2S/c1-5-9(10(16)17)18-11(14-5)15-6-2-3-8(13)7(12)4-6/h2-4H,1H3,(H,14,15)(H,16,17)