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N-[2-((2E)-2-{[5-(4-bromophenyl)-2-furyl]methylene}hydrazino)-2-oxoethyl]-4-methylbenzenesulfonamide
SpectraBase Compound ID BhEngtU1mkw
InChI InChI=1S/C20H18BrN3O4S/c1-14-2-9-18(10-3-14)29(26,27)23-13-20(25)24-22-12-17-8-11-19(28-17)15-4-6-16(21)7-5-15/h2-12,23H,13H2,1H3,(H,24,25)/b22-12+
InChIKey WJPNAZSMVYCJCH-WSDLNYQXSA-N
Mol Weight 476.35 g/mol
Molecular Formula C20H18BrN3O4S
Exact Mass 475.02014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Z0izE3kzAL
Name N-[2-((2E)-2-{[5-(4-Bromophenyl)-2-furyl]methylene}hydrazino)-2-oxoethyl]-4-methylbenzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 475.020140242 u
Formula C20H18BrN3O4S
InChI InChI=1S/C20H18BrN3O4S/c1-14-2-9-18(10-3-14)29(26,27)23-13-20(25)24-22-12-17-8-11-19(28-17)15-4-6-16(21)7-5-15/h2-12,23H,13H2,1H3,(H,24,25)/b22-12+
InChIKey WJPNAZSMVYCJCH-WSDLNYQXSA-N
Molecular Weight 476.345 g/mol
SMILES N(S(C=1C=CC(=CC1)C)(=O)=O)CC(N\N=C\C=1OC(C=2C=CC(Br)=CC2)=CC1)=O