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5-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}-2-methoxy-N-methylbenzamide

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5-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}-2-methoxy-N-methylbenzamide
SpectraBase Compound ID GAN3vbNGzzG
InChI InChI=1S/C28H31N5O5S/c1-17-10-11-18(14-24(17)39(36,37)33-28(2,3)16-34)25-20-8-6-7-9-21(20)26(32-31-25)30-19-12-13-23(38-5)22(15-19)27(35)29-4/h6-15,33-34H,16H2,1-5H3,(H,29,35)(H,30,32)
InChIKey IPNKYYXGSGZZDO-UHFFFAOYSA-N
Mol Weight 549.65 g/mol
Molecular Formula C28H31N5O5S
Exact Mass 549.20459 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8K5J9dY38Gh
Name 5-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}-2-methoxy-N-methylbenzamide
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/C28H31N5O5S/c1-17-10-11-18(14-24(17)39(36,37)33-28(2,3)16-34)25-20-8-6-7-9-21(20)26(32-31-25)30-19-12-13-23(38-5)22(15-19)27(35)29-4/h6-15,33-34H,16H2,1-5H3,(H,29,35)(H,30,32)
InChIKey IPNKYYXGSGZZDO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14950
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: C26470; Labnumber: RRAZ1-2339; SBI_ID: SBI-014953
Temperature 313 °C