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2-[4-chloro-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]-N-cyclopropylacetamide

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2-[4-chloro-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]-N-cyclopropylacetamide
SpectraBase Compound ID 7TAuidZ6Mdf
InChI InChI=1S/C22H22ClN3O/c1-14-3-7-16(8-4-14)21-20(23)22(17-9-5-15(2)6-10-17)26(25-21)13-19(27)24-18-11-12-18/h3-10,18H,11-13H2,1-2H3,(H,24,27)
InChIKey HIEWVZIMLSWUAR-UHFFFAOYSA-N
Mol Weight 379.89 g/mol
Molecular Formula C22H22ClN3O
Exact Mass 379.14514 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7R4OAQVPEv3
Name 2-[4-Chloro-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]-N-cyclopropylacetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.145140039 u
Formula C22H22ClN3O
InChI InChI=1S/C22H22ClN3O/c1-14-3-7-16(8-4-14)21-20(23)22(17-9-5-15(2)6-10-17)26(25-21)13-19(27)24-18-11-12-18/h3-10,18H,11-13H2,1-2H3,(H,24,27)
InChIKey HIEWVZIMLSWUAR-UHFFFAOYSA-N
Molecular Weight 379.891 g/mol
SMILES N(C(=O)CN1C(=C(Cl)C(=N1)C=1C=CC(=CC1)C)C=1C=CC(=CC1)C)C1CC1