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1-(2-Chlorophenyl)-5-[(2-chlorophenyl)carbonylamino]-N-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
SpectraBase Compound ID 1pDoHxgK2s8
InChI InChI=1S/C24H15Cl2F3N4O2/c25-18-9-2-1-8-16(18)22(34)32-21-17(13-30-33(21)20-11-4-3-10-19(20)26)23(35)31-15-7-5-6-14(12-15)24(27,28)29/h1-13H,(H,31,35)(H,32,34)
InChIKey PWPMEANMWNJMOC-UHFFFAOYSA-N
Mol Weight 519.31 g/mol
Molecular Formula C24H15Cl2F3N4O2
Exact Mass 518.052416 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YDOV1cCc7q
Name 1-(2-Chlorophenyl)-5-[(2-chlorophenyl)carbonylamino]-N-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 518.052415626 u
Formula C24H15Cl2F3N4O2
InChI InChI=1S/C24H15Cl2F3N4O2/c25-18-9-2-1-8-16(18)22(34)32-21-17(13-30-33(21)20-11-4-3-10-19(20)26)23(35)31-15-7-5-6-14(12-15)24(27,28)29/h1-13H,(H,31,35)(H,32,34)
InChIKey PWPMEANMWNJMOC-UHFFFAOYSA-N
Molecular Weight 519.311 g/mol
SMILES C=1(N(N=CC1C(NC1=CC(C(F)(F)F)=CC=C1)=O)C1=C(Cl)C=CC=C1)NC(C1=C(Cl)C=CC=C1)=O