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5-methyl-1,3-diphenyl-N-[4-(1H-pyrazol-1-yl)benzyl]-1H-pyrazole-4-carboxamide

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5-methyl-1,3-diphenyl-N-[4-(1H-pyrazol-1-yl)benzyl]-1H-pyrazole-4-carboxamide
SpectraBase Compound ID B7W4l5uCkjd
InChI InChI=1S/C27H23N5O/c1-20-25(27(33)28-19-21-13-15-23(16-14-21)31-18-8-17-29-31)26(22-9-4-2-5-10-22)30-32(20)24-11-6-3-7-12-24/h2-18H,19H2,1H3,(H,28,33)
InChIKey UMGUVBXWGGFFNG-UHFFFAOYSA-N
Mol Weight 433.52 g/mol
Molecular Formula C27H23N5O
Exact Mass 433.19026 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4VCVOCIfSdC
Name 5-Methyl-1,3-diphenyl-N-[4-(1H-pyrazol-1-yl)benzyl]-1H-pyrazole-4-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.190260380 u
Formula C27H23N5O
InChI InChI=1S/C27H23N5O/c1-20-25(27(33)28-19-21-13-15-23(16-14-21)31-18-8-17-29-31)26(22-9-4-2-5-10-22)30-32(20)24-11-6-3-7-12-24/h2-18H,19H2,1H3,(H,28,33)
InChIKey UMGUVBXWGGFFNG-UHFFFAOYSA-N
Molecular Weight 433.515 g/mol
SMILES N(C(C1=C(N(C=2C=CC=CC2)N=C1C1=CC=CC=C1)C)=O)CC1=CC=C(N2N=CC=C2)C=C1