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2-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-3-(4-methylphenyl)-2,3-dihydro-4(1H)-quinazolinone
SpectraBase Compound ID 5EEezI2CJUb
InChI InChI=1S/C30H25N3O2S2/c1-19-11-14-22(15-12-19)33-28(31-24-8-4-3-7-23(24)29(33)34)20-13-16-26(35-2)21(17-20)18-36-30-32-25-9-5-6-10-27(25)37-30/h3-17,28,31H,18H2,1-2H3
InChIKey WIJAYUJUVGGHFM-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 4t6r1Caw8Ku
Name 2-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-3-(4-methylphenyl)-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/c1-19-11-14-22(15-12-19)33-28(31-24-8-4-3-7-23(24)29(33)34)20-13-16-26(35-2)21(17-20)18-36-30-32-25-9-5-6-10-27(25)37-30/h3-17,28,31H,18H2,1-2H3
InChIKey WIJAYUJUVGGHFM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16063
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: D09877; Labnumber: KHAN-0105; SBI_ID: SBI-016066
Temperature 318 °C