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(6Z)-5-imino-6-{3-[2-(3-methylphenoxy)ethoxy]benzylidene}-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID IavowZN5FpP
InChI InChI=1S/C24H24N4O3S/c1-3-6-21-27-28-22(25)20(23(29)26-24(28)32-21)15-17-8-5-10-19(14-17)31-12-11-30-18-9-4-7-16(2)13-18/h4-5,7-10,13-15,25H,3,6,11-12H2,1-2H3/b20-15-,25-22?
InChIKey DXHSWUQJFBBPAI-JRCZNVDKSA-N
Mol Weight 448.54 g/mol
Molecular Formula C24H24N4O3S
Exact Mass 448.156912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AyUfE7fQrsg
Name (6Z)-5-imino-6-{3-[2-(3-methylphenoxy)ethoxy]benzylidene}-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/C24H24N4O3S/c1-3-6-21-27-28-22(25)20(23(29)26-24(28)32-21)15-17-8-5-10-19(14-17)31-12-11-30-18-9-4-7-16(2)13-18/h4-5,7-10,13-15,25H,3,6,11-12H2,1-2H3/b20-15-,25-22?
InChIKey DXHSWUQJFBBPAI-JRCZNVDKSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7443
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: 127233; Labnumber: CEP2K-01266; VK_ID: VK-007447
Synonyms 5-imino-6-{3-[2-(3-methylphenoxy)ethoxy]benzylidene}-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 315 °C