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(6Z)-6-({1-[3-(2,3-dimethylphenoxy)propyl]-1H-indol-3-yl}methylene)-5-imino-2-methyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 9tZmB686uWm
InChI InChI=1S/C27H26N4O2S/c1-17-8-6-11-24(19(17)3)33-13-7-12-30-16-20(21-9-4-5-10-23(21)30)14-22-25(28)31-15-18(2)34-27(31)29-26(22)32/h4-6,8-11,14-16,28H,7,12-13H2,1-3H3/b22-14-,28-25?
InChIKey XRHNSLVMRMWZDX-JHKOBTARSA-N
Mol Weight 470.59 g/mol
Molecular Formula C27H26N4O2S
Exact Mass 470.177647 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Zv6XYqgYME
Name (6Z)-6-({1-[3-(2,3-dimethylphenoxy)propyl]-1H-indol-3-yl}methylene)-5-imino-2-methyl-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/C27H26N4O2S/c1-17-8-6-11-24(19(17)3)33-13-7-12-30-16-20(21-9-4-5-10-23(21)30)14-22-25(28)31-15-18(2)34-27(31)29-26(22)32/h4-6,8-11,14-16,28H,7,12-13H2,1-3H3/b22-14-,28-25?
InChIKey XRHNSLVMRMWZDX-JHKOBTARSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28195
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: D80978; Labnumber: CEP4-2930; SBI_ID: SBI-028199
Synonyms 6-({1-[3-(2,3-dimethylphenoxy)propyl]-1H-indol-3-yl}methylene)-5-imino-2-methyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C