4-azanyl-3-[2-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylic acid

Systemtic Name: 4-azanyl-3-[2-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylic acid Openeye Name: 4-amino-3-[2-(trifluoromethyl)phenyl]isothiazole-5-carboxylic acid CAS Name: 4-amino-3-[2-(trifluoromethyl)phenyl]-5-isothiazolecarboxylic acid IUPAC Name: 4-amino-3-[2-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylic acid Traditional Name: 4-amino-3-[2-(trifluoromethyl)phenyl]isothiazole-5-carboxylic acid Formula: C11H7F3N2O2S MolecularWeight: 288.24569

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NSC(=C2N)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NSC(=C2N)C(=O)O)C(F)(F)F

InChI

InChI=1S/C11H7F3N2O2S/c12-11(13,14)6-4-2-1-3-5(6)8-7(15)9(10(17)18)19-16-8/h1-4H,15H2,(H,17,18)