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ethyl (2Z)-2-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}benzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID GunSUT9U8Z4
InChI InChI=1S/C32H27F3N2O5S/c1-4-41-30(39)27-19(2)36-31-37(28(27)21-9-6-5-7-10-21)29(38)26(43-31)16-20-13-14-25(40-3)22(15-20)18-42-24-12-8-11-23(17-24)32(33,34)35/h5-17,28H,4,18H2,1-3H3/b26-16-
InChIKey SNHRRLBGYYXZKT-QQXSKIMKSA-N
Mol Weight 608.6 g/mol
Molecular Formula C32H27F3N2O5S
Exact Mass 608.159278 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L0ulh8crnh0
Name ethyl (2Z)-2-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}benzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-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/C32H27F3N2O5S/c1-4-41-30(39)27-19(2)36-31-37(28(27)21-9-6-5-7-10-21)29(38)26(43-31)16-20-13-14-25(40-3)22(15-20)18-42-24-12-8-11-23(17-24)32(33,34)35/h5-17,28H,4,18H2,1-3H3/b26-16-
InChIKey SNHRRLBGYYXZKT-QQXSKIMKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2668
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: 9312554; UBI_ID: UBI-002669
Synonyms ethyl 2-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}benzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 308 °C