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4H-pyrido[1,2-a]pyrimidin-4-one, 2-[[3-(1H-imidazol-1-yl)propyl]amino]-3-[(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-
SpectraBase Compound ID G5dFuXj8Bbq
InChI InChI=1S/C21H22N6O3S2/c1-30-12-11-27-20(29)16(32-21(27)31)13-15-18(23-6-4-8-25-10-7-22-14-25)24-17-5-2-3-9-26(17)19(15)28/h2-3,5,7,9-10,13-14,23H,4,6,8,11-12H2,1H3/b16-13-
InChIKey ZABFFOCILKIKTF-SSZFMOIBSA-N
Mol Weight 470.57 g/mol
Molecular Formula C21H22N6O3S2
Exact Mass 470.119481 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID INxOgSsOi6r
Name 4H-pyrido[1,2-a]pyrimidin-4-one, 2-[[3-(1H-imidazol-1-yl)propyl]amino]-3-[(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-5-thiazolidinylidene]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/C21H22N6O3S2/c1-30-12-11-27-20(29)16(32-21(27)31)13-15-18(23-6-4-8-25-10-7-22-14-25)24-17-5-2-3-9-26(17)19(15)28/h2-3,5,7,9-10,13-14,23H,4,6,8,11-12H2,1H3/b16-13-
InChIKey ZABFFOCILKIKTF-SSZFMOIBSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2863
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/11248407