2-[3-(4-bromophenyl)-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[3-(4-bromophenyl)-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[3-(4-bromophenyl)-5-(trifluoromethyl)pyrazol-1-yl]thiazole-4-carboxylic acid CAS Name: 2-[3-(4-bromophenyl)-5-(trifluoromethyl)-1-pyrazolyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[3-(4-bromophenyl)-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[3-(4-bromophenyl)-5-(trifluoromethyl)pyrazol-1-yl]thiazole-4-carboxylic acid Formula: C14H7BrF3N3O2S MolecularWeight: 418.18849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=C2)C(F)(F)F)C3=NC(=CS3)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=C2)C(F)(F)F)C3=NC(=CS3)C(=O)O)Br

InChI

InChI=1S/C14H7BrF3N3O2S/c15-8-3-1-7(2-4-8)9-5-11(14(16,17)18)21(20-9)13-19-10(6-24-13)12(22)23/h1-6H,(H,22,23)