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1-isopropyl-3,6-dimethyl-4-({4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}carbonyl)-1H-pyrazolo[3,4-b]pyridine
SpectraBase Compound ID LBJjnZXXsJV
InChI InChI=1S/C23H29N5O3S/c1-15(2)28-22-21(18(5)25-28)20(14-17(4)24-22)23(29)26-10-12-27(13-11-26)32(30,31)19-8-6-16(3)7-9-19/h6-9,14-15H,10-13H2,1-5H3
InChIKey JLHDAHHSDLEDEV-UHFFFAOYSA-N
Mol Weight 455.58 g/mol
Molecular Formula C23H29N5O3S
Exact Mass 455.199111 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DSyis03ZgWh
Name 1-isopropyl-3,6-dimethyl-4-({4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}carbonyl)-1H-pyrazolo[3,4-b]pyridine
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/C23H29N5O3S/c1-15(2)28-22-21(18(5)25-28)20(14-17(4)24-22)23(29)26-10-12-27(13-11-26)32(30,31)19-8-6-16(3)7-9-19/h6-9,14-15H,10-13H2,1-5H3
InChIKey JLHDAHHSDLEDEV-UHFFFAOYSA-N
NMR Offset 17.912
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_32380
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: 1847620; SBI_ID: SBI-032384
Temperature 303 °C