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1-methyl-N-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxamide
SpectraBase Compound ID 1W2UYMKvbDn
InChI InChI=1S/C18H13F3N6O3S2/c1-27-16-12(14(25-27)18(19,20)21)9-13(31-16)15(28)24-10-3-5-11(6-4-10)32(29,30)26-17-22-7-2-8-23-17/h2-9H,1H3,(H,24,28)(H,22,23,26)
InChIKey IKPWYVNWWWBLGE-UHFFFAOYSA-N
Mol Weight 482.46 g/mol
Molecular Formula C18H13F3N6O3S2
Exact Mass 482.044265 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 67WZ6CjDrFu
Name 1-methyl-N-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxamide
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/C18H13F3N6O3S2/c1-27-16-12(14(25-27)18(19,20)21)9-13(31-16)15(28)24-10-3-5-11(6-4-10)32(29,30)26-17-22-7-2-8-23-17/h2-9H,1H3,(H,24,28)(H,22,23,26)
InChIKey IKPWYVNWWWBLGE-UHFFFAOYSA-N
NMR Offset 15.3209
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33890
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: 1998025; SBI_ID: SBI-033894
Temperature 297 °C