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ethyl 2-{[(1-isopropyl-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID JnHdQUCceoQ
InChI InChI=1S/C21H26N4O3S/c1-8-28-21(27)16-12(5)14(7)29-20(16)23-19(26)15-9-11(4)22-18-17(15)13(6)24-25(18)10(2)3/h9-10H,8H2,1-7H3,(H,23,26)
InChIKey VTRYGLFKGOHDMC-UHFFFAOYSA-N
Mol Weight 414.52 g/mol
Molecular Formula C21H26N4O3S
Exact Mass 414.172562 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CJqIKZM9oe
Name ethyl 2-{[(1-isopropyl-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate
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/C21H26N4O3S/c1-8-28-21(27)16-12(5)14(7)29-20(16)23-19(26)15-9-11(4)22-18-17(15)13(6)24-25(18)10(2)3/h9-10H,8H2,1-7H3,(H,23,26)
InChIKey VTRYGLFKGOHDMC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32863
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: 1911668; SBI_ID: SBI-032867
Temperature 318 °C