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(6Z)-6-(3-bromobenzylidene)-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 1XnH2ZsKMUp
InChI InChI=1S/C15H13BrN4OS/c1-2-4-12-19-20-13(17)11(14(21)18-15(20)22-12)8-9-5-3-6-10(16)7-9/h3,5-8,17H,2,4H2,1H3/b11-8-,17-13?
InChIKey AFYMXKZIHRRRJQ-ZWGDPFMXSA-N
Mol Weight 377.26 g/mol
Molecular Formula C15H13BrN4OS
Exact Mass 375.999345 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5yiVoJZ4f1H
Name (6Z)-6-(3-bromobenzylidene)-5-imino-2-propyl-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/C15H13BrN4OS/c1-2-4-12-19-20-13(17)11(14(21)18-15(20)22-12)8-9-5-3-6-10(16)7-9/h3,5-8,17H,2,4H2,1H3/b11-8-,17-13?
InChIKey AFYMXKZIHRRRJQ-ZWGDPFMXSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7438
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: 127227; Labnumber: CEP2K-01111; VK_ID: VK-007442
Synonyms 6-(3-bromobenzylidene)-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 315 °C