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1-ethyl-N-{4-[(2-methoxyanilino)sulfonyl]phenyl}-1H-pyrazole-3-carboxamide
SpectraBase Compound ID 7UQoAw2QqQ5
InChI InChI=1S/C19H20N4O4S/c1-3-23-13-12-17(21-23)19(24)20-14-8-10-15(11-9-14)28(25,26)22-16-6-4-5-7-18(16)27-2/h4-13,22H,3H2,1-2H3,(H,20,24)
InChIKey VAKXMMLKSJDBMY-UHFFFAOYSA-N
Mol Weight 400.45 g/mol
Molecular Formula C19H20N4O4S
Exact Mass 400.120526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JzaHK5ABQ24
Name 1-Ethyl-N-{4-[(2-methoxyanilino)sulfonyl]phenyl}-1H-pyrazole-3-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.120526310 u
Formula C19H20N4O4S
InChI InChI=1S/C19H20N4O4S/c1-3-23-13-12-17(21-23)19(24)20-14-8-10-15(11-9-14)28(25,26)22-16-6-4-5-7-18(16)27-2/h4-13,22H,3H2,1-2H3,(H,20,24)
InChIKey VAKXMMLKSJDBMY-UHFFFAOYSA-N
Molecular Weight 400.453 g/mol
SMILES N(C1=CC=C(S(NC2=C(OC)C=CC=C2)(=O)=O)C=C1)C(C1=NN(CC)C=C1)=O