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N-(4-{[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-2-[(4-methyl-5,6,7,8-tetrahydro-2-quinazolinyl)sulfanyl]acetamide
SpectraBase Compound ID 35ZMS7Kma3e
InChI InChI=1S/C23H26N6O3S2/c1-14-12-15(2)25-22(24-14)29-34(31,32)18-10-8-17(9-11-18)27-21(30)13-33-23-26-16(3)19-6-4-5-7-20(19)28-23/h8-12H,4-7,13H2,1-3H3,(H,27,30)(H,24,25,29)
InChIKey XDFAIXOFWQOVOA-UHFFFAOYSA-N
Mol Weight 498.62 g/mol
Molecular Formula C23H26N6O3S2
Exact Mass 498.150781 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ErndwTX3qEZ
Name N-(4-{[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-2-[(4-methyl-5,6,7,8-tetrahydro-2-quinazolinyl)sulfanyl]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/C23H26N6O3S2/c1-14-12-15(2)25-22(24-14)29-34(31,32)18-10-8-17(9-11-18)27-21(30)13-33-23-26-16(3)19-6-4-5-7-20(19)28-23/h8-12H,4-7,13H2,1-3H3,(H,27,30)(H,24,25,29)
InChIKey XDFAIXOFWQOVOA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9859
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: D60758; Labnumber: VGU-30677; SBI_ID: SBI-009862
Temperature 306 °C