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(7Z)-7-(5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-(4-methoxyphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
SpectraBase Compound ID JawAxGT4E04
InChI InChI=1S/C21H18N4O4S/c1-28-13-5-3-12(4-6-13)24-10-22-21-25(11-24)20(27)18(30-21)17-15-9-14(29-2)7-8-16(15)23-19(17)26/h3-9H,10-11H2,1-2H3,(H,23,26)/b18-17-
InChIKey PQYLQIPNJCZXIP-ZCXUNETKSA-N
Mol Weight 422.46 g/mol
Molecular Formula C21H18N4O4S
Exact Mass 422.104876 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AxbycQN37Z5
Name (7Z)-7-(5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-(4-methoxyphenyl)-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/C21H18N4O4S/c1-28-13-5-3-12(4-6-13)24-10-22-21-25(11-24)20(27)18(30-21)17-15-9-14(29-2)7-8-16(15)23-19(17)26/h3-9H,10-11H2,1-2H3,(H,23,26)/b18-17-
InChIKey PQYLQIPNJCZXIP-ZCXUNETKSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_839
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: C74897; Labnumber: RRKU-1562; SBI_ID: SBI-000841
Synonyms 7-(5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-(4-methoxyphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Temperature 308 °C