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(6E)-5-imino-6-({1-[3-(4-methoxyphenoxy)propyl]-1H-indol-3-yl}methylene)-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID OydplgVd77
InChI InChI=1S/C29H24N6O3S/c1-37-21-9-11-22(12-10-21)38-15-5-14-34-18-20(23-7-2-3-8-25(23)34)16-24-26(30)35-29(32-27(24)36)39-28(33-35)19-6-4-13-31-17-19/h2-4,6-13,16-18,30H,5,14-15H2,1H3/b24-16+,30-26?
InChIKey ZJHYBNOPZSZNBE-GRMHFLANSA-N
Mol Weight 536.61 g/mol
Molecular Formula C29H24N6O3S
Exact Mass 536.16306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2mDB79F9snK
Name (6E)-5-imino-6-({1-[3-(4-methoxyphenoxy)propyl]-1H-indol-3-yl}methylene)-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-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/C29H24N6O3S/c1-37-21-9-11-22(12-10-21)38-15-5-14-34-18-20(23-7-2-3-8-25(23)34)16-24-26(30)35-29(32-27(24)36)39-28(33-35)19-6-4-13-31-17-19/h2-4,6-13,16-18,30H,5,14-15H2,1H3/b24-16+,30-26?
InChIKey ZJHYBNOPZSZNBE-GRMHFLANSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19827
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: D14635; Labnumber: CEP5-0945; SBI_ID: SBI-019831
Synonyms 5-imino-6-({1-[3-(4-methoxyphenoxy)propyl]-1H-indol-3-yl}methylene)-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C