N-[4-fluoranyl-2-(hydroxymethyl)-1,3-benzothiazol-5-yl]-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: N-[4-fluoranyl-2-(hydroxymethyl)-1,3-benzothiazol-5-yl]-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: N-[4-fluoro-2-(hydroxymethyl)-1,3-benzothiazol-5-yl]-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: N-[4-fluoro-2-(hydroxymethyl)-1,3-benzothiazol-5-yl]-2-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: N-[4-fluoro-2-(hydroxymethyl)-1,3-benzothiazol-5-yl]-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: N-(4-fluoro-2-methylol-1,3-benzothiazol-5-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C14H10F4N4O2S MolecularWeight: 374.313413

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(F)(F)F)C(=O)NC2=C(C3=C(C=C2)SC(=N3)CO)F

Isomeric SMILES

CN1C(=CC(=N1)C(F)(F)F)C(=O)NC2=C(C3=C(C=C2)SC(=N3)CO)F

InChI

InChI=1S/C14H10F4N4O2S/c1-22-7(4-9(21-22)14(16,17)18)13(24)19-6-2-3-8-12(11(6)15)20-10(5-23)25-8/h2-4,23H,5H2,1H3,(H,19,24)