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3-{2-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

View entire compound with spectra: 1 NMR

3-{2-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID GyY6E5gpYcA
InChI InChI=1S/C17H17F3N4O3S/c1-9-6-16(27,17(18,19)20)24(22-9)12(25)7-23-8-21-14-13(15(23)26)10-4-2-3-5-11(10)28-14/h8,27H,2-7H2,1H3
InChIKey AYVHHKWMBUNXIE-UHFFFAOYSA-N
Mol Weight 414.4 g/mol
Molecular Formula C17H17F3N4O3S
Exact Mass 414.097346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FitbdhF2Y8Z
Name 3-{2-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
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/C17H17F3N4O3S/c1-9-6-16(27,17(18,19)20)24(22-9)12(25)7-23-8-21-14-13(15(23)26)10-4-2-3-5-11(10)28-14/h8,27H,2-7H2,1H3
InChIKey AYVHHKWMBUNXIE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9223
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/1074686; Labnumber: HY-PRZCF/3137; UZI_ID: UZI-009225
Temperature 308 °C