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2-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-3-benzyl-2,3-dihydro-4(1H)-quinazolinone
SpectraBase Compound ID GLoGYqkBz7D
InChI InChI=1S/C30H25N3O2S2/c1-35-26-16-15-21(17-22(26)19-36-30-32-25-13-7-8-14-27(25)37-30)28-31-24-12-6-5-11-23(24)29(34)33(28)18-20-9-3-2-4-10-20/h2-17,28,31H,18-19H2,1H3
InChIKey HYMSKPQGNMGULS-UHFFFAOYSA-N
Mol Weight 523.67 g/mol
Molecular Formula C30H25N3O2S2
Exact Mass 523.138819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5XMxgQJzPho
Name 2-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-3-benzyl-2,3-dihydro-4(1H)-quinazolinone
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/C30H25N3O2S2/c1-35-26-16-15-21(17-22(26)19-36-30-32-25-13-7-8-14-27(25)37-30)28-31-24-12-6-5-11-23(24)29(34)33(28)18-20-9-3-2-4-10-20/h2-17,28,31H,18-19H2,1H3
InChIKey HYMSKPQGNMGULS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12624
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: 101097; Labnumber: NCD1-099; VK_ID: VK-012629
Temperature 318 °C