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benzenesulfonamide, 4-[[(1Z)-1-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)ethyl]amino]-N-(2-pyridinyl)-
SpectraBase Compound ID IOgpeKCXmGR
InChI InChI=1S/C23H21N5O3S/c1-16(22-17(2)26-28(23(22)29)19-8-4-3-5-9-19)25-18-11-13-20(14-12-18)32(30,31)27-21-10-6-7-15-24-21/h3-15,25H,1-2H3,(H,24,27)/b22-16-
InChIKey ACDGIFVVMOEASV-JWGURIENSA-N
Mol Weight 447.51 g/mol
Molecular Formula C23H21N5O3S
Exact Mass 447.136511 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtWDuEX1LuJ
Name Benzenesulfonamide, 4-[[(1Z)-1-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)ethyl]amino]-N-(2-pyridinyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.136510727 u
Formula C23H21N5O3S
InChI InChI=1S/C23H21N5O3S/c1-16(22-17(2)26-28(23(22)29)19-8-4-3-5-9-19)25-18-11-13-20(14-12-18)32(30,31)27-21-10-6-7-15-24-21/h3-15,25H,1-2H3,(H,24,27)/b22-16-
InChIKey ACDGIFVVMOEASV-JWGURIENSA-N
Molecular Weight 447.513 g/mol
SMILES N(\C(=C/1C(N(C=2C=CC=CC2)N=C1C)=O)C)C1=CC=C(S(NC2=NC=CC=C2)(=O)=O)C=C1