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1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4,8-dihydro-4-(4-hydroxy-3,5-dimethoxyphenyl)-1-(6-methoxy-2-benzothiazolyl)-3-methyl-
SpectraBase Compound ID GarGIqgeJxM
InChI InChI=1S/C23H22N4O5S2/c1-11-19-21(12-7-15(31-3)20(29)16(8-12)32-4)33-10-18(28)25-22(19)27(26-11)23-24-14-6-5-13(30-2)9-17(14)34-23/h5-9,21,29H,10H2,1-4H3,(H,25,28)
InChIKey VEHDJAPJPKLKCD-UHFFFAOYSA-N
Mol Weight 498.57 g/mol
Molecular Formula C23H22N4O5S2
Exact Mass 498.103162 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GqAJcFsyhzV
Name 1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4,8-dihydro-4-(4-hydroxy-3,5-dimethoxyphenyl)-1-(6-methoxy-2-benzothiazolyl)-3-methyl-
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/C23H22N4O5S2/c1-11-19-21(12-7-15(31-3)20(29)16(8-12)32-4)33-10-18(28)25-22(19)27(26-11)23-24-14-6-5-13(30-2)9-17(14)34-23/h5-9,21,29H,10H2,1-4H3,(H,25,28)
InChIKey VEHDJAPJPKLKCD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3604
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/17231325; Labnumber: DUD-7030123