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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-butyl-5,6-dihydro-5-imino-6-[[1-(2-phenoxyethyl)-1H-indol-3-yl]methylene]-, (6Z)-
SpectraBase Compound ID GtViZAkAtSX
InChI InChI=1S/C26H25N5O2S/c1-2-3-13-23-29-31-24(27)21(25(32)28-26(31)34-23)16-18-17-30(22-12-8-7-11-20(18)22)14-15-33-19-9-5-4-6-10-19/h4-12,16-17,27H,2-3,13-15H2,1H3/b21-16-,27-24?
InChIKey GAKYCQCKTBMDLV-FWMAWXJYSA-N
Mol Weight 471.58 g/mol
Molecular Formula C26H25N5O2S
Exact Mass 471.172896 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DLQDtMEacp8
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-butyl-5,6-dihydro-5-imino-6-[[1-(2-phenoxyethyl)-1H-indol-3-yl]methylene]-, (6Z)-
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/C26H25N5O2S/c1-2-3-13-23-29-31-24(27)21(25(32)28-26(31)34-23)16-18-17-30(22-12-8-7-11-20(18)22)14-15-33-19-9-5-4-6-10-19/h4-12,16-17,27H,2-3,13-15H2,1H3/b21-16-,27-24?
InChIKey GAKYCQCKTBMDLV-FWMAWXJYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2495
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: NMR/11269151