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(7E)-2-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-3-(2-thienyl)-7-(2-thienylmethylene)-3,3a,4,5,6,7-hexahydro-2H-indazole

View entire compound with spectra: 1 NMR

(7E)-2-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-3-(2-thienyl)-7-(2-thienylmethylene)-3,3a,4,5,6,7-hexahydro-2H-indazole
SpectraBase Compound ID 99lw3C3Ef2p
InChI InChI=1S/C23H21F3N4OS2/c1-14-11-19(23(24,25)26)27-29(14)13-20(31)30-22(18-8-4-10-33-18)17-7-2-5-15(21(17)28-30)12-16-6-3-9-32-16/h3-4,6,8-12,17,22H,2,5,7,13H2,1H3/b15-12+
InChIKey GBBJXBASWHMJCA-NTCAYCPXSA-N
Mol Weight 490.56 g/mol
Molecular Formula C23H21F3N4OS2
Exact Mass 490.110888 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GkpJQvrqtuQ
Name (7E)-2-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-3-(2-thienyl)-7-(2-thienylmethylene)-3,3a,4,5,6,7-hexahydro-2H-indazole
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/C23H21F3N4OS2/c1-14-11-19(23(24,25)26)27-29(14)13-20(31)30-22(18-8-4-10-33-18)17-7-2-5-15(21(17)28-30)12-16-6-3-9-32-16/h3-4,6,8-12,17,22H,2,5,7,13H2,1H3/b15-12+
InChIKey GBBJXBASWHMJCA-NTCAYCPXSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16470
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/1023936; Labnumber: OLG0198; UZI_ID: UZI-016474
Synonyms 2-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-3-(2-thienyl)-7-(2-thienylmethylene)-3,3a,4,5,6,7-hexahydro-2H-indazole
Temperature 305 °C