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4-(2-hydroxyethyl)-5-methyl-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazol-3-one
SpectraBase Compound ID A4RoWh30gxj
InChI InChI=1S/C15H13F3N4O2S/c1-8-9(4-5-23)13(24)22(21-8)14-19-10(11-3-2-6-25-11)7-12(20-14)15(16,17)18/h2-3,6-7,21,23H,4-5H2,1H3
InChIKey ULWPRQIWEDSHEB-UHFFFAOYSA-N
Mol Weight 370.35 g/mol
Molecular Formula C15H13F3N4O2S
Exact Mass 370.071131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Vr2NcPgl8P
Name 4-(2-hydroxyethyl)-5-methyl-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazol-3-one
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Formula C15H13F3N4O2S
InChI InChI=1S/C15H13F3N4O2S/c1-8-9(4-5-23)13(24)22(21-8)14-19-10(11-3-2-6-25-11)7-12(20-14)15(16,17)18/h2-3,6-7,21,23H,4-5H2,1H3
InChIKey ULWPRQIWEDSHEB-UHFFFAOYSA-N
Molecular Weight 370.350 g/mol
SMILES N1C(=C(CCO)C(N1c1nc(cc(n1)C(F)(F)F)-c1cccs1)=O)C
SPLASH splash10-000i-0039000000-b061921005c952b60de0
Source of Spectrum C5-2005-812-3
Synonyms 4-(2-hydroxyethyl)-5-methyl-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-pyrazolin-3-one 4-(2-hydroxyethyl)-5-methyl-2-[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]-1H-pyrazol-3-one 4-(2-hydroxyethyl)-5-methyl-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazol-3-one
Wiley ID 1618234