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6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-[(7-ethyl-4-methyl-2-quinazolinyl)amino]-4(1H)-pyrimidinone
SpectraBase Compound ID 16qBSBaSBEn
InChI InChI=1S/C23H20N6OS2/c1-3-14-8-9-16-13(2)24-21(26-18(16)10-14)29-22-25-15(11-20(30)28-22)12-31-23-27-17-6-4-5-7-19(17)32-23/h4-11H,3,12H2,1-2H3,(H2,24,25,26,28,29,30)
InChIKey XCVHMTMAPGLIDF-UHFFFAOYSA-N
Mol Weight 460.57 g/mol
Molecular Formula C23H20N6OS2
Exact Mass 460.114002 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9dsNuoo9J9q
Name 6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-[(7-ethyl-4-methyl-2-quinazolinyl)amino]-4(1H)-pyrimidinone
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/C23H20N6OS2/c1-3-14-8-9-16-13(2)24-21(26-18(16)10-14)29-22-25-15(11-20(30)28-22)12-31-23-27-17-6-4-5-7-19(17)32-23/h4-11H,3,12H2,1-2H3,(H2,24,25,26,28,29,30)
InChIKey XCVHMTMAPGLIDF-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7047
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: D27396; Labnumber: VGU-18661; SBI_ID: SBI-007050
Temperature 315 °C