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Urea, N-[4-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl]-N'-(2-thienylcarbonyl)-
SpectraBase Compound ID 1MBoTmnOrbv
InChI InChI=1S/C17H13F3N4O2S/c1-10-9-14(17(18,19)20)24(23-10)12-6-4-11(5-7-12)21-16(26)22-15(25)13-3-2-8-27-13/h2-9H,1H3,(H2,21,22,25,26)
InChIKey PSYLPZQOXKFGQU-UHFFFAOYSA-N
Mol Weight 394.37 g/mol
Molecular Formula C17H13F3N4O2S
Exact Mass 394.071131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRiYkA9CQkR
Name Urea, N-[4-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl]-N'-(2-thienylcarbonyl)-
Alternate Name(s) N-[[4-[3-methyl-5-(trifluoromethyl)-1-pyrazolyl]anilino]-oxomethyl]-2-thiophenecarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F3N4O2S
InChI InChI=1S/C17H13F3N4O2S/c1-10-9-14(17(18,19)20)24(23-10)12-6-4-11(5-7-12)21-16(26)22-15(25)13-3-2-8-27-13/h2-9H,1H3,(H2,21,22,25,26)
InChIKey PSYLPZQOXKFGQU-UHFFFAOYSA-N
Molecular Weight 394.372 g/mol
SMILES N(C(Nc1ccc(-[n]2nc(cc2C(F)(F)F)C)cc1)=O)C(=O)c1sccc1
SPLASH splash10-03xu-9620000000-5a9042730148b91cb06d
Source of Spectrum IY-1-4478-4
Wiley ID 1652767