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2-({5-[(4-bromo-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID 6uA1EuWKDem
InChI InChI=1S/C19H19BrN4O3S/c1-10-2-4-13-15(6-10)28-19(16(13)17(21)25)23-18(26)14-5-3-12(27-14)9-24-8-11(20)7-22-24/h3,5,7-8,10H,2,4,6,9H2,1H3,(H2,21,25)(H,23,26)
InChIKey GDNUVZBHSYAVRV-UHFFFAOYSA-N
Mol Weight 463.35 g/mol
Molecular Formula C19H19BrN4O3S
Exact Mass 462.036125 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HXTGkv2vlUV
Name 2-({5-[(4-bromo-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-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/C19H19BrN4O3S/c1-10-2-4-13-15(6-10)28-19(16(13)17(21)25)23-18(26)14-5-3-12(27-14)9-24-8-11(20)7-22-24/h3,5,7-8,10H,2,4,6,9H2,1H3,(H2,21,25)(H,23,26)
InChIKey GDNUVZBHSYAVRV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13281
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: UZI/9098861; UBI_ID: UBI-013284
Temperature 308 °C