2-[1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-(4-fluoroanilino)-1-methyl-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[1-(4-fluoroanilino)-1-oxopropan-2-yl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[1-(4-fluoroanilino)-1-oxopropan-2-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-(4-fluoroanilino)-2-keto-1-methyl-ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C14H13FN2O3S MolecularWeight: 308.328023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13FN2O3S/c1-7(13-16-8(2)11(21-13)14(19)20)12(18)17-10-5-3-9(15)4-6-10/h3-7H,1-2H3,(H,17,18)(H,19,20)