For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

methyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

View entire compound with spectra: 1 NMR

methyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID IWAkVITWim0
InChI InChI=1S/C30H24F2N4O3S/c1-39-30(38)25-20-13-12-19(17-8-4-2-5-9-17)14-24(20)40-29(25)35-28(37)21-16-33-36-23(26(31)32)15-22(34-27(21)36)18-10-6-3-7-11-18/h2-11,15-16,19,26H,12-14H2,1H3,(H,35,37)
InChIKey ZWILIWUKMBFJCT-UHFFFAOYSA-N
Mol Weight 558.6 g/mol
Molecular Formula C30H24F2N4O3S
Exact Mass 558.153718 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DsbBW0A79JK
Name methyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C30H24F2N4O3S/c1-39-30(38)25-20-13-12-19(17-8-4-2-5-9-17)14-24(20)40-29(25)35-28(37)21-16-33-36-23(26(31)32)15-22(34-27(21)36)18-10-6-3-7-11-18/h2-11,15-16,19,26H,12-14H2,1H3,(H,35,37)
InChIKey ZWILIWUKMBFJCT-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3120
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: 9314712; UBI_ID: UBI-003121
Temperature 313 °C