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ethanediamide, N~1~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~2~-[2-(1-piperidinylcarbonyl)phenyl]-
SpectraBase Compound ID 43hlSoKPvjp
InChI InChI=1S/C20H25N5O3/c1-14-15(13-24(2)23-14)12-21-18(26)19(27)22-17-9-5-4-8-16(17)20(28)25-10-6-3-7-11-25/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3,(H,21,26)(H,22,27)
InChIKey LGYVAXGRKMPDFR-UHFFFAOYSA-N
Mol Weight 383.45 g/mol
Molecular Formula C20H25N5O3
Exact Mass 383.19574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 378Ib4q2TCt
Name Ethanediamide, N~1~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~2~-[2-(1-piperidinylcarbonyl)phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 383.195739682 u
Formula C20H25N5O3
InChI InChI=1S/C20H25N5O3/c1-14-15(13-24(2)23-14)12-21-18(26)19(27)22-17-9-5-4-8-16(17)20(28)25-10-6-3-7-11-25/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3,(H,21,26)(H,22,27)
InChIKey LGYVAXGRKMPDFR-UHFFFAOYSA-N
Molecular Weight 383.452 g/mol
SMILES N(C(C(NC1=C(C(N2CCCCC2)=O)C=CC=C1)=O)=O)CC=1C(=NN(C1)C)C