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ethyl 2-({[1-methyl-3-(4-morpholinylcarbonyl)-1H-pyrazol-5-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 36itDzIaSiZ
InChI InChI=1S/C21H26N4O5S/c1-3-30-21(28)17-13-6-4-5-7-16(13)31-19(17)22-18(26)15-12-14(23-24(15)2)20(27)25-8-10-29-11-9-25/h12H,3-11H2,1-2H3,(H,22,26)
InChIKey MATWVDOHGFRCJH-UHFFFAOYSA-N
Mol Weight 446.52 g/mol
Molecular Formula C21H26N4O5S
Exact Mass 446.162391 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G5xVq7ukuXY
Name ethyl 2-({[1-methyl-3-(4-morpholinylcarbonyl)-1H-pyrazol-5-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C21H26N4O5S/c1-3-30-21(28)17-13-6-4-5-7-16(13)31-19(17)22-18(26)15-12-14(23-24(15)2)20(27)25-8-10-29-11-9-25/h12H,3-11H2,1-2H3,(H,22,26)
InChIKey MATWVDOHGFRCJH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33357
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: 1927313; SBI_ID: SBI-033361
Temperature 318 °C