3-(3,5-dimethylpyrazol-1-yl)-1-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-1-propanone IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]propan-1-one Formula: C12H15F3N4O2 MolecularWeight: 304.26831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)N2C(CC=N2)(C(F)(F)F)O)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)N2[C@](CC=N2)(C(F)(F)F)O)C

InChI

InChI=1S/C12H15F3N4O2/c1-8-7-9(2)18(17-8)6-3-10(20)19-11(21,4-5-16-19)12(13,14)15/h5,7,21H,3-4,6H2,1-2H3/t11-/m0/s1