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2-thiophenecarboxylic acid, 3-[[[(3,4-dihydro-4-oxo-8-phenylpyrazolo[1,5-a][1,3,5]triazin-2-yl)thio]acetyl]amino]-, methyl ester

View entire compound with spectra: 1 NMR

2-thiophenecarboxylic acid, 3-[[[(3,4-dihydro-4-oxo-8-phenylpyrazolo[1,5-a][1,3,5]triazin-2-yl)thio]acetyl]amino]-, methyl ester
SpectraBase Compound ID 7uGqOmBp8fW
InChI InChI=1S/C19H15N5O4S2/c1-28-17(26)15-13(7-8-29-15)21-14(25)10-30-18-22-16-12(11-5-3-2-4-6-11)9-20-24(16)19(27)23-18/h2-9H,10H2,1H3,(H,21,25)(H,22,23,27)
InChIKey GSDNXEBBLLEHKC-UHFFFAOYSA-N
Mol Weight 441.48 g/mol
Molecular Formula C19H15N5O4S2
Exact Mass 441.056546 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AGfhfKEOtmD
Name 2-thiophenecarboxylic acid, 3-[[[(3,4-dihydro-4-oxo-8-phenylpyrazolo[1,5-a][1,3,5]triazin-2-yl)thio]acetyl]amino]-, methyl ester
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/C19H15N5O4S2/c1-28-17(26)15-13(7-8-29-15)21-14(25)10-30-18-22-16-12(11-5-3-2-4-6-11)9-20-24(16)19(27)23-18/h2-9H,10H2,1H3,(H,21,25)(H,22,23,27)
InChIKey GSDNXEBBLLEHKC-UHFFFAOYSA-N
NMR Offset 18.0262
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3483
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: NMR/16322331; Labnumber: DUD-701314