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2-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(4-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino}phenyl)-4-phenyl-6-quinazolinyl]acetamide

View entire compound with spectra: 1 NMR

2-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(4-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino}phenyl)-4-phenyl-6-quinazolinyl]acetamide
SpectraBase Compound ID Boql77nDs8t
InChI InChI=1S/C38H26N6O2S4/c45-33(21-47-37-42-29-10-4-6-12-31(29)49-37)39-25-16-14-24(15-17-25)36-41-28-19-18-26(20-27(28)35(44-36)23-8-2-1-3-9-23)40-34(46)22-48-38-43-30-11-5-7-13-32(30)50-38/h1-20H,21-22H2,(H,39,45)(H,40,46)
InChIKey TVBUVTVAXRYZIW-UHFFFAOYSA-N
Mol Weight 726.9 g/mol
Molecular Formula C38H26N6O2S4
Exact Mass 726.100009 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4lchQa1UGg7
Name 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(4-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino}phenyl)-4-phenyl-6-quinazolinyl]acetamide
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/C38H26N6O2S4/c45-33(21-47-37-42-29-10-4-6-12-31(29)49-37)39-25-16-14-24(15-17-25)36-41-28-19-18-26(20-27(28)35(44-36)23-8-2-1-3-9-23)40-34(46)22-48-38-43-30-11-5-7-13-32(30)50-38/h1-20H,21-22H2,(H,39,45)(H,40,46)
InChIKey TVBUVTVAXRYZIW-UHFFFAOYSA-N
NMR Offset 15.4978
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5349
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: UZI/8151925; UBI_ID: UBI-005351
Temperature 315 °C