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1-[(4-chlorophenyl)sulfonyl]-4-{5-[(3,5-dimethyl-4-isoxazolyl)methyl]-2-furoyl}piperazine
SpectraBase Compound ID 6F9k0as8YvA
InChI InChI=1S/C21H22ClN3O5S/c1-14-19(15(2)30-23-14)13-17-5-8-20(29-17)21(26)24-9-11-25(12-10-24)31(27,28)18-6-3-16(22)4-7-18/h3-8H,9-13H2,1-2H3
InChIKey RGEKXGHTHJVRRF-UHFFFAOYSA-N
Mol Weight 463.94 g/mol
Molecular Formula C21H22ClN3O5S
Exact Mass 463.09687 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BBBZVGWDQ2B
Name 1-[(4-chlorophenyl)sulfonyl]-4-{5-[(3,5-dimethyl-4-isoxazolyl)methyl]-2-furoyl}piperazine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H22ClN3O5S/c1-14-19(15(2)30-23-14)13-17-5-8-20(29-17)21(26)24-9-11-25(12-10-24)31(27,28)18-6-3-16(22)4-7-18/h3-8H,9-13H2,1-2H3
InChIKey RGEKXGHTHJVRRF-UHFFFAOYSA-N
NMR Offset 17.9147
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_32618
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1882831; SBI_ID: SBI-032622
Temperature 303 °C