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(7Z)-7-(1,5-dimethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
SpectraBase Compound ID ANuQeqbiyVD
InChI InChI=1S/C22H17F3N4O2S/c1-12-6-7-16-15(8-12)17(19(30)27(16)2)18-20(31)29-11-28(10-26-21(29)32-18)14-5-3-4-13(9-14)22(23,24)25/h3-9H,10-11H2,1-2H3/b18-17-
InChIKey UZNFACYFRUIWIX-ZCXUNETKSA-N
Mol Weight 458.46 g/mol
Molecular Formula C22H17F3N4O2S
Exact Mass 458.102431 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1mF2foMoxeW
Name (7Z)-7-(1,5-dimethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-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/C22H17F3N4O2S/c1-12-6-7-16-15(8-12)17(19(30)27(16)2)18-20(31)29-11-28(10-26-21(29)32-18)14-5-3-4-13(9-14)22(23,24)25/h3-9H,10-11H2,1-2H3/b18-17-
InChIKey UZNFACYFRUIWIX-ZCXUNETKSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_843
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: C74904; Labnumber: RRKU-1592; SBI_ID: SBI-000845
Synonyms 7-(1,5-dimethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Temperature 308 °C