1-(4-phenyl-1,3-thiazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-phenyl-1,3-thiazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Openeye Name: 1-(4-phenylthiazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid CAS Name: 1-(4-phenyl-2-thiazolyl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-phenyl-1,3-thiazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Traditional Name: 1-(4-phenylthiazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Formula: C14H8F3N3O2S MolecularWeight: 339.29243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)N3C(=C(C=N3)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)N3C(=C(C=N3)C(=O)O)C(F)(F)F

InChI

InChI=1S/C14H8F3N3O2S/c15-14(16,17)11-9(12(21)22)6-18-20(11)13-19-10(7-23-13)8-4-2-1-3-5-8/h1-7H,(H,21,22)