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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-heptyl-5,6-dihydro-5-imino-6-[[5-(2-nitrophenyl)-2-furanyl]methylene]-, (6Z)-
SpectraBase Compound ID E1DrUIMeb7u
InChI InChI=1S/C23H23N5O4S/c1-2-3-4-5-6-11-20-26-27-21(24)17(22(29)25-23(27)33-20)14-15-12-13-19(32-15)16-9-7-8-10-18(16)28(30)31/h7-10,12-14,24H,2-6,11H2,1H3/b17-14-,24-21?
InChIKey VFDIKNKOKSVVTA-FIAPBCBLSA-N
Mol Weight 465.53 g/mol
Molecular Formula C23H23N5O4S
Exact Mass 465.147075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FG55dMV4JkF
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-heptyl-5,6-dihydro-5-imino-6-[[5-(2-nitrophenyl)-2-furanyl]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/C23H23N5O4S/c1-2-3-4-5-6-11-20-26-27-21(24)17(22(29)25-23(27)33-20)14-15-12-13-19(32-15)16-9-7-8-10-18(16)28(30)31/h7-10,12-14,24H,2-6,11H2,1H3/b17-14-,24-21?
InChIKey VFDIKNKOKSVVTA-FIAPBCBLSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2457
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/11269106