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5-({4-[(5-chloro-2-methoxyphenyl)sulfonyl]-1-piperazinyl}carbonyl)-3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazole
SpectraBase Compound ID FhvvN9Q3coJ
InChI InChI=1S/C25H25ClN4O4S2/c1-16-6-4-5-7-20(16)30-25-19(17(2)27-30)15-22(35-25)24(31)28-10-12-29(13-11-28)36(32,33)23-14-18(26)8-9-21(23)34-3/h4-9,14-15H,10-13H2,1-3H3
InChIKey RMWWKUHADYPCAZ-UHFFFAOYSA-N
Mol Weight 545.07 g/mol
Molecular Formula C25H25ClN4O4S2
Exact Mass 544.100575 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1d7A4in1grZ
Name 5-({4-[(5-chloro-2-methoxyphenyl)sulfonyl]-1-piperazinyl}carbonyl)-3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazole
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/C25H25ClN4O4S2/c1-16-6-4-5-7-20(16)30-25-19(17(2)27-30)15-22(35-25)24(31)28-10-12-29(13-11-28)36(32,33)23-14-18(26)8-9-21(23)34-3/h4-9,14-15H,10-13H2,1-3H3
InChIKey RMWWKUHADYPCAZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14427
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: D99470; Labnumber: GRESKO-8350; SBI_ID: SBI-014430
Synonyms 4-chloro-2-[(4-{[3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazol-5-yl]carbonyl}-1-piperazinyl)sulfonyl]phenyl methyl ether
Temperature 318 °C