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N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

View entire compound with spectra: 1 NMR

N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID F7xDYT12CGO
InChI InChI=1S/C28H30F3N5O2S/c1-27(2,3)16-7-10-18-19(14-32)26(39-22(18)11-16)34-25(37)21-13-24-33-20(15-5-8-17(38-4)9-6-15)12-23(28(29,30)31)36(24)35-21/h5-6,8-9,13,16,20,23,33H,7,10-12H2,1-4H3,(H,34,37)
InChIKey SUUFXRZPFNMEBV-UHFFFAOYSA-N
Mol Weight 557.64 g/mol
Molecular Formula C28H30F3N5O2S
Exact Mass 557.207231 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 497it20vk90
Name N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-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/C28H30F3N5O2S/c1-27(2,3)16-7-10-18-19(14-32)26(39-22(18)11-16)34-25(37)21-13-24-33-20(15-5-8-17(38-4)9-6-15)12-23(28(29,30)31)36(24)35-21/h5-6,8-9,13,16,20,23,33H,7,10-12H2,1-4H3,(H,34,37)
InChIKey SUUFXRZPFNMEBV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12909
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/9099345; UBI_ID: UBI-012912
Temperature 308 °C