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(6E)-6-{3-ethoxy-4-[3-(4-methylphenoxy)propoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID BAZ3DUqh3fP
InChI InChI=1S/C31H29N3O4S/c1-3-36-28-19-22(12-15-27(28)38-17-7-16-37-24-13-10-21(2)11-14-24)18-25-29(32)34-26(23-8-5-4-6-9-23)20-39-31(34)33-30(25)35/h4-6,8-15,18-20,32H,3,7,16-17H2,1-2H3/b25-18+,32-29?
InChIKey YSNHRVAHJGVHOX-FUBACRQPSA-N
Mol Weight 539.65 g/mol
Molecular Formula C31H29N3O4S
Exact Mass 539.187878 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2pXzHluw6Wo
Name (6E)-6-{3-ethoxy-4-[3-(4-methylphenoxy)propoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[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/C31H29N3O4S/c1-3-36-28-19-22(12-15-27(28)38-17-7-16-37-24-13-10-21(2)11-14-24)18-25-29(32)34-26(23-8-5-4-6-9-23)20-39-31(34)33-30(25)35/h4-6,8-15,18-20,32H,3,7,16-17H2,1-2H3/b25-18+,32-29?
InChIKey YSNHRVAHJGVHOX-FUBACRQPSA-N
NMR Offset 15.4988
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7608
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: 127439; Labnumber: CEP2K-10320; VK_ID: VK-007612
Synonyms 6-{3-ethoxy-4-[3-(4-methylphenoxy)propoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Temperature 315 °C